Oxyquinoline

Oxyquinoline

SCHEMBL2867503

CC(=O)O.CC(=O)O.CC(=O)O.Oc1cccc2cccnc12

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Oxyquinoline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 2/20 0.78
▸ TSHR P16473 2/20 0.78
▸ METAP2 P50579 2/20 0.78
▸ METAP1 P53582 2/20 0.78
▸ CHRM1 P11229 1/20 0.78
▸ COMT P21964 1/20 0.78
▸ ADRA1A P35348 1/20 0.78
▸ HDAC8 Q9BY41 1/20 0.78
▸ KDM4E B2RXH2 7/20 0.71
▸ ALOX12 P18054 2/20 0.71
▸ ALDH1A1 P00352 5/20 0.71
▸ LMNA P02545 3/20 0.71
▸ KMT2A Q03164 2/20 0.51
▸ PARP1 P09874 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ KDM4A O75164 2/20 0.49
▸ EGLN1 Q9GZT9 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Oxyquinoline SCHEMBL4465896 1.00 MMP2 (0.78) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL15568316 0.98 MMP2 (0.75) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL5965842 0.94 MMP2 (0.81) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL27553390 0.93 MMP2 (0.78) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL28459062 0.92 MMP2 (0.84) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL866498 0.91 MMP2 (0.75) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL28315442 0.91 MMP2 (0.81) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL28042473 0.91 MMP2 (0.81) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL27477171 0.91 MMP2 (0.81) MMP2TSHRMETAP2METAP1CHRM1
Oxyquinoline SCHEMBL28191778 0.90 TSHR (0.95) MMP2TSHRMETAP2METAP1CHRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140135485-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-05-15 — — US disclosed
EP-1506214-B1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARM INC (US) 2010-01-20 — — EP disclosed
US-20090324577-A1 6-11 Bicyclic Ketolide Derivatives OR YAT SUN 2009-12-31 — — US disclosed
US-20070244160-A1 6-11 Bicyclic Ketolide Derivatives OR YAT SUN 2007-10-18 — — US disclosed
US-7273853-B2 6-11 bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2007-09-25 — — US disclosed
US-7189704-B2 6-11 bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2007-03-13 — — US disclosed
US-7129221-B2 6,11-bicyclic erythromycin derivatives ENANTA PHARMACEUTICALS, INC. (US) 2006-10-31 — — US disclosed
US-7064110-B2 6-11 bicycle ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2006-06-20 — — US disclosed
US-20050282758-A1 6-11 Bicyclic ketolide derivatives NIU DEQIANG 2005-12-22 — — US disclosed
US-20050159370-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2005-07-21 — — US disclosed
EP-1509538-A1 6,11 BICYCLIC ERYTHROMYCIN DERIVATIVES Enanta Pharmaceuticals, Inc. (US) 2005-03-02 — — EP disclosed
US-20050037982-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. 2005-02-17 — — US disclosed
EP-1506214-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES Enanta Pharmaceuticals, Inc. (US) 2005-02-16 — — EP disclosed
US-20040157787-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. 2004-08-12 — — US disclosed
US-20040053861-A1 6,11-Bicyclic erythromycin derivatives ENANTA PHARMACEUTICALS, INC. 2004-03-18 — — US disclosed
WO-2003097659-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2003-11-27 — — WO disclosed
WO-2003095466-A1 6,11 BICYCLIC ERYTHROMYCIN DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2003-11-20 — — WO disclosed
EP-1272500-A2 PROCESS FOR PREPARING 6-O-ALKENYL-SUBSITUTED ERYTHROMYCIN DERIVATIVES Abbott Laboratories (US) 2003-01-08 — — EP disclosed
US-6437106-B1 ALKYLATION WITH ALKENYL CARBONATE OR CARBAMATE IN PRESENCE OF PALLADIUM CATALYST AND PHOSPHINE; CYCLIZATION ABBOTT LABORATORIES 2002-08-20 — — US disclosed
WO-2000078773-A2 PROCESS FOR PREPARING 6-O-ALKENYL-SUBSTITUTED ERYTHROMYCIN DERIV ATIVES ABBOTT LABORATORIES (US) 2000-12-28 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140135485-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885
US-20040053861-A1 6,11-Bicyclic erythromycin derivatives ABCB11, CYP2B6, CYP2D6 MMP2 1555/4885TSHR 3410/4885METAP2 2628/4885
US-20050282758-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885
US-20070244160-A1 6-11 Bicyclic Ketolide Derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885
US-20090324577-A1 6-11 Bicyclic Ketolide Derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885
US-20050037982-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885
US-20040157787-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1782/4885TSHR 4083/4885METAP2 3792/4885
US-20050159370-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 MMP2 1833/4885TSHR 4172/4885METAP2 3785/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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