SCHEMBL13587014

SCHEMBL13587014

COc1ccc(-c2ccc(/C=C3/NC(=S)N(C(Cc4ccccc4)C(=O)O)C3=O)s2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ CRHBP P24387 1/20 0.54
▸ CRHR2 Q13324 1/20 0.54
▸ PTPN1 P18031 2/20 0.48
▸ BCL2 P10415 4/20 0.43
▸ BCL2L2 Q92843 4/20 0.43
▸ BAD Q92934 4/20 0.43
▸ PRF1 P14222 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ MCL1 Q07820 1/20 0.42
▸ BAK1 Q16611 1/20 0.42
▸ HSD17B2 P37059 1/20 0.42
▸ PSMB5 P28074 1/20 0.41
▸ PLA2G1B P04054 1/20 0.41

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
SCHEMBL1134035 1.00 MAPT (0.54) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL4374614 1.00 MAPT (0.54) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL4380180 0.89 MAPT (0.42) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1133671 0.89 MAPT (0.42) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1133612 0.88 PRF1 (0.49) MAPTALDH1A1MEN1KMT2ABCL2
SCHEMBL1133613 0.88 PRF1 (0.49) MAPTALDH1A1MEN1KMT2ABCL2
SCHEMBL13587022 0.88 PRF1 (0.49) MAPTALDH1A1MEN1KMT2APTPN1
SCHEMBL4377150 0.88 BCL2L2 (0.52) MAPTALDH1A1MEN1KMT2APTPN1
SCHEMBL13587021 0.88 PRF1 (0.49) MAPTALDH1A1MEN1KMT2ABCL2
SCHEMBL13587018 0.88 BCL2L2 (0.52) MAPTALDH1A1MEN1KMT2APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2285802-B1 OXO-IMIDAZOLYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY ASTEX PHARMACEUTICALS INC (US) 2015-11-11 — — EP disclosed
US-8759384-B2 Oxo-imidazolyl compounds ASTEXPHRMACEUTICALS, INC. 2014-06-24 — — US disclosed
US-8759384-B2 Oxo-imidazolyl compounds ASTEXPHRMACEUTICALS, INC. 2014-06-24 — — US disclosed
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE THE ROCKEFELLER UNIVERSITY (US) 2014-03-13 — — US disclosed
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE THE ROCKEFELLER UNIVERSITY (US) 2014-03-13 — — US disclosed
WO-2014026009-A2 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE AVACYN PHARMACEUTICALS, INC. (US) 2014-02-13 — — WO disclosed
US-20090298900-A1 Oxo-Imidazolyl Compounds ASTEXPHRMACEUTICALS, INC. 2009-12-03 — — US disclosed
US-20090298900-A1 Oxo-Imidazolyl Compounds ASTEXPHRMACEUTICALS, INC. 2009-12-03 — — US disclosed
WO-2009139870-A1 OXO-IMIDAZOLYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY SUPERGEN, INC. 2009-11-19 — — 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-20090298900-A1 Oxo-Imidazolyl Compounds GALE, CYP51A1, GNE MAPT 4793/4885ALDH1A1 965/4885MEN1 2988/4885
US-20140073639-A1 INHIBITION OF ANTIMICROBIAL TARGETS WITH REDUCED POTENTIAL FOR RESISTANCE GALE, ENGASE, MGAM MAPT 4832/4885ALDH1A1 4168/4885MEN1 4627/4885

“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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