SCHEMBL4122864

SCHEMBL4122864

COc1cccc(-c2ccc3cc(-c4nc5cc(C(=O)O)ccc5n4C4CCCCC4)ccc3n2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
THRB P10828 3/20 0.48
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PTGER4 P35408 1/20 0.44
VDR P11473 4/20 0.43
NR1H4 Q96RI1 4/20 0.43
PIK3CA P42336 3/20 0.42
MTOR P42345 3/20 0.42
IDH1 O75874 2/20 0.42
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 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
SCHEMBL4125017 0.93 L3MBTL1 (0.55) L3MBTL1THRBPTGER4VDRNR1H4
SCHEMBL13904613 0.91 L3MBTL1 (0.48) L3MBTL1THRBMAPTRXFP1PTGER4
SCHEMBL4124725 0.91 L3MBTL1 (0.48) L3MBTL1THRBMAPTRXFP1PTGER4
SCHEMBL4118792 0.90 L3MBTL1 (0.48) L3MBTL1PTGER4VDRNR1H4IDH1
SCHEMBL14382783 0.90 L3MBTL1 (0.61) L3MBTL1THRBMAPTRXFP1PTGER4
SCHEMBL13904716 0.89 L3MBTL1 (0.49) L3MBTL1THRBPTGER4VDRNR1H4
SCHEMBL4125294 0.89 L3MBTL1 (0.58) L3MBTL1PTGER4VDRNR1H4IDH1
SCHEMBL13904470 0.89 L3MBTL1 (0.47) L3MBTL1THRBMAPTPTGER4VDR
SCHEMBL4125330 0.88 L3MBTL1 (0.53) L3MBTL1PTGER4VDRNR1H4IDH1
SCHEMBL4130835 0.88 L3MBTL1 (0.58) L3MBTL1PTGER4VDRNR1H4IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007501189-A 2007-01-25 JP claimed
EP-1651631-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC. (US) 2006-05-03 EP claimed
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 US claimed
WO-2005012288-A1 BICYCLIC IMIDAZOL DERIVATIVES AGAINST FLAVIVIRIDAE GENELABS TECHNOLOGIES, INC (US) 2005-02-10 WO claimed
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
US-7511145-B2 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. (US) 2009-03-31 US disclosed
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 US disclosed
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 US disclosed
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 US disclosed
US-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 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-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES HAVCR2, MAVS, ZC3HAV1 L3MBTL1 1221/4885THRB 4182/4885MAPT 2748/4885
US-20050187390-A1 Bicyclic heteroaryl derivatives HAVCR2, MAVS, ZC3HAV1 L3MBTL1 1221/4885THRB 4182/4885MAPT 2748/4885

“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.