SCHEMBL1163239

SCHEMBL1163239

O=C(O)Cc1c[nH]c2ccc(F)c(O)c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.59
▸ KDM4E B2RXH2 3/20 0.59
▸ GAA P10253 2/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ THRB P10828 1/20 0.59
▸ DNMT1 P26358 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ CASP6 P55212 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ MCL1 Q07820 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ TSHR P16473 2/20 0.54
▸ NPSR1 Q6W5P4 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ GLA P06280 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51

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
SCHEMBL27942653 0.86 GPR84 (0.65) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL12596191 0.82 GPR84 (0.50) KDM4EMEN1RECQLKMT2ATSHR
SCHEMBL4206904 0.79 ALDH1A1 (0.69) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL31708197 0.79 HTR2A (0.63) MAPTRECQLKMT2ATSHRNPSR1
SCHEMBL31708081 0.75 HTR2A (0.61) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL9755961 0.74 ALDH1A1 (0.58) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL29441752 0.74 ALDH1A1 (1.00) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL7358453 0.74 ALDH1A1 (1.00) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL29441750 0.74 ALDH1A1 (1.00) ALDH1A1KDM4EGAATDP1MEN1
SCHEMBL3804978 0.74 HTR2A (0.67) HTR2AHTR2CHTR7MPOSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 — — US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 — — US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 — — US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 — — US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 — — US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 — — US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 — — US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 — — US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 — — US disclosed
EP-2464227-A1 COMPOUNDS AND METHODS OF USE THEREOF Galenea Corporation (US) 2012-06-20 — — EP disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 — — US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 — — US disclosed
WO-2011019738-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2011-02-17 — — WO disclosed
WO-2011019738-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2011-02-17 — — 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 (3 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-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ALDH1A1 277/4885KDM4E 2857/4885GAA 544/4885
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ALDH1A1 277/4885KDM4E 2857/4885GAA 544/4885
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ALDH1A1 277/4885KDM4E 2857/4885GAA 544/4885

“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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