SCHEMBL1444187

SCHEMBL1444187

Cc1c(C(=O)O)oc2ccc(-c3ccccc3)cc12

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 3/20 0.63
▸ KDM4E B2RXH2 3/20 0.56
▸ GPR35 Q9HC97 1/20 0.55
▸ HPGD P15428 6/20 0.54
▸ GAA P10253 2/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ TSHR P16473 1/20 0.53
▸ NR1H4 Q96RI1 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PLA2G2A P14555 2/20 0.46
▸ PLA2G4A P47712 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46

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
SCHEMBL1444097 0.88 MCL1 (0.60) MCL1KDM4EGPR35HPGDGAA
SCHEMBL3499014 0.88 MCL1 (0.78) MCL1KDM4EGPR35HPGDGAA
SCHEMBL10293616 0.88 MCL1 (0.63) MCL1KDM4EGPR35HPGDGAA
SCHEMBL1444461 0.87 MCL1 (0.59) MCL1KDM4EGPR35HPGDGAA
SCHEMBL10007918 0.83 KDM4E (0.58) KDM4EGAASMN1; SMN2MEN1KMT2A
SCHEMBL10007230 0.83 MCL1 (0.55) MCL1KDM4EGPR35HPGDGAA
SCHEMBL9217459 0.83 PTPN1 (0.50) MCL1KDM4EHPGDTSHRL3MBTL1
SCHEMBL10374396 0.83 PLA2G2A (0.47) MCL1KDM4ETSHRPLA2G2APLA2G4A
SCHEMBL23610605 0.81 NPC1 (0.52) KDM4EHPGDSMN1; SMN2TSHRALDH1A1
SCHEMBL6239909 0.81 KDM4E (0.45) MCL1KDM4EHPGDSMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2477498-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE Schering Corporation (US) 2012-07-25 — — EP disclosed
US-20120172369-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP. 2012-07-05 — — US disclosed
US-20120172369-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP. 2012-07-05 — — US disclosed
US-20120172369-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP. 2012-07-05 — — US disclosed
WO-2011031628-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2011-03-17 — — WO disclosed
WO-2011031628-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2011-03-17 — — 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 (1 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-20120172369-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT MCL1 2056/4885KDM4E 1503/4885GPR35 666/4885

“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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