SCHEMBL17941970

SCHEMBL17941970

O=C(O)c1ccc2c(=O)[nH]c(-c3ccc(Cl)s3)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.55
▸ RECQL P46063 1/20 0.55
▸ CSNK2A2 P19784 2/20 0.55
▸ CSNK2B P67870 2/20 0.55
▸ PDE5A O76074 1/20 0.49
▸ HPGD P15428 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NCOA2 Q15596 1/20 0.43
▸ NCOA1 Q15788 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ CSNK2A1 P68400 2/20 0.40
▸ PKM P14618 1/20 0.40

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
SCHEMBL17941888 0.86 TNKS (0.51) KDM4ERECQLCSNK2A2CSNK2BMEN1
SCHEMBL3863014 0.84 CSNK2A2 (0.49) KDM4ECSNK2A2CSNK2BHPGDMEN1
SCHEMBL403461 0.78 KDM4E (0.65) KDM4ERECQLCSNK2A2CSNK2BPDE5A
SCHEMBL19223667 0.72 KDM4E (0.57) KDM4EHPGDMEN1ALDH1A1KMT2A
SCHEMBL12743857 0.71 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1
SCHEMBL404603 0.70 PDE5A (0.72) KDM4ERECQLPDE5AMEN1ALDH1A1
SCHEMBL17941948 0.70 CSNK2A2 (0.51) KDM4ECSNK2A2CSNK2BHPGDMEN1
SCHEMBL12351809 0.70 HPGD (0.69) KDM4EHPGDALDH1A1LMNAGAA
SCHEMBL7383662 0.69 KDM4E (0.50) KDM4ERECQLPDE5AHPGDMEN1
SCHEMBL405547 0.68 PDE5A (0.81) KDM4ERECQLCSNK2A2CSNK2BPDE5A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3247705-B1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF AS NAMPT INHIBITORS MILLENNIUM PHARM INC (US) 2019-11-20 — — EP disclosed
US-10323018-B2 Quinazoline and quinoline compounds and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2019-06-18 — — US disclosed
US-10323018-B2 Quinazoline and quinoline compounds and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2019-06-18 — — US disclosed
US-20180009784-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2018-01-11 — — US disclosed
US-20180009784-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2018-01-11 — — US disclosed
EP-3247705-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF Millennium Pharmaceuticals, Inc. (US) 2017-11-29 — — EP disclosed
WO-2016118565-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-28 — — WO disclosed
WO-2016118565-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-28 — — 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 (2 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-10323018-B2 Quinazoline and quinoline compounds and uses thereof NAMPT, NQO2, NNMT KDM4E 582/4885RECQL 42/4885CSNK2A2 2663/4885
US-20180009784-A1 QUINAZOLINE AND QUINOLINE COMPOUNDS AND USES THEREOF NAMPT, NQO2, NNMT KDM4E 582/4885RECQL 42/4885CSNK2A2 2663/4885

“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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