SCHEMBL2367557

SCHEMBL2367557

Cc1c(C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)nnn1Cc1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
PTGER4 P35408 2/20 0.48
MAPT P10636 2/20 0.47
P2RY14 Q15391 2/20 0.47
TP53 P04637 2/20 0.46
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL2367550 0.90 MAPT (0.57) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2367243 0.89 POLB (0.61) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2368399 0.89 PTGER4 (0.52) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL1923270 0.87 PTGDR2 (0.47) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2367686 0.86 POLB (0.59) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2367782 0.85 RAB9A (0.55) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2368030 0.84 MAPT (0.55) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL2368159 0.83 MEN1 (0.61) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL15329651 0.83 PTGDR2 (0.44) POLBMEN1KMT2ARAB9AMAPT
SCHEMBL2368342 0.81 POLB (0.53) POLBMEN1KMT2APTGER4P2RY14

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
US-9051281-B2 Compounds GLAXOSMITHKLINE LLC (US) 2015-06-09 US disclosed
EP-2368887-B1 1, 2, 3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-02-26 EP disclosed
US-20130281499-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2013-10-24 US disclosed
US-8486977-B2 1,2,3-triazole derivatives for use as stearoyl-CoA desaturase inhibitors GLAXOSMITHKLINE LLC (US) 2013-07-16 US disclosed
EP-2368887-A1 1, 2, 3-triazole derivatives for use as stearoyl-COA desaturase inhibitors Glaxosmithkline LLC (US) 2011-09-28 EP disclosed
US-20100297054-A1 1,2,3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2010-11-25 US 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-20100297054-A1 1,2,3-TRIAZOLE DERIVATIVES FOR USE AS STEAROYL-COA DESATURASE INHIBITORS SCD, SCD5, FASN POLB 3739/4885MEN1 4834/4885KMT2A 3195/4885
US-20130281499-A1 COMPOUNDS CYP11B2, SCD, CYP11B1 POLB 3817/4885MEN1 3507/4885KMT2A 4427/4885

“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.