SCHEMBL4138274

SCHEMBL4138274

O=C(O)Cc1cccc(-c2ccc3cc(-c4nc5cc(C(=O)O)ccc5n4C4CCCCC4)ccc3n2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
BMPR2 Q13873 1/20 0.43
VDR P11473 4/20 0.40
NR1H4 Q96RI1 4/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PTGER4 P35408 3/20 0.40
JAK3 P52333 2/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39
HCAR3 P49019 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OGFRL1 Q5TC84 1/20 0.38

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
SCHEMBL4125294 0.89 L3MBTL1 (0.58) L3MBTL1VDRNR1H4HDAC1HDAC8
SCHEMBL4125330 0.88 L3MBTL1 (0.53) L3MBTL1BMPR2VDRNR1H4HDAC1
SCHEMBL4122761 0.88 L3MBTL1 (0.57) L3MBTL1VDRNR1H4HDAC1HDAC8
SCHEMBL4116517 0.87 L3MBTL1 (0.55) L3MBTL1BMPR2VDRNR1H4HDAC1
SCHEMBL4118792 0.86 L3MBTL1 (0.48) L3MBTL1BMPR2VDRNR1H4HDAC1
SCHEMBL4125933 0.86 L3MBTL1 (0.51) L3MBTL1BMPR2VDRNR1H4HDAC1
SCHEMBL4118996 0.85 L3MBTL1 (0.50) L3MBTL1
SCHEMBL4122864 0.85 L3MBTL1 (0.52) L3MBTL1VDRNR1H4PTGER4HSD17B10
SCHEMBL4129929 0.85 L3MBTL1 (0.56) L3MBTL1BMPR2HSD17B10GAA
SCHEMBL4130835 0.85 L3MBTL1 (0.58) L3MBTL1BMPR2VDRNR1H4PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES GENELABS TECHNOLOGIES, INC. 2009-03-26 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 (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-20090081165-A1 BICYCLIC HETEROARYL DERIVATIVES HAVCR2, MAVS, ZC3HAV1 L3MBTL1 1221/4885BMPR2 4096/4885VDR 2346/4885

“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.