SCHEMBL7814224

SCHEMBL7814224

O=C(c1ccccc1)c1ccc(SCc2ccccc2)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.59
MRGPRX4 Q96LA9 1/20 0.59
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA3 P07451 2/20 0.45
CA4 P22748 2/20 0.45
CA6 P23280 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA13 Q8N1Q1 2/20 0.45
CA14 Q9ULX7 2/20 0.45
CA5B Q9Y2D0 2/20 0.45
SRD5A2 P31213 3/20 0.45
PTPRG P23470 1/20 0.45
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
VCAM1 P19320 1/20 0.44
PTPRC P08575 1/20 0.42

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
SCHEMBL13452529 0.88 MRGPRX4 (0.70) ARMRGPRX4CA12CA1CA2
SCHEMBL8304982 0.82 L3MBTL1 (0.44) ARMRGPRX4SRD5A2ATMTDP1
SCHEMBL7895923 0.82 ACHE (0.48) ARMRGPRX4SRD5A2ATMTDP1
SCHEMBL7809728 0.82 AR (0.45) ARMRGPRX4CA12CA1CA2
SCHEMBL13452610 0.82 AR (0.52) ARMRGPRX4CA1CA2L3MBTL1
SCHEMBL11293089 0.81 ATM (0.53) SRD5A2ATMTDP1L3MBTL1VCAM1
SCHEMBL7897148 0.81 AR (0.48) ARMRGPRX4CA12CA1CA2
SCHEMBL4568726 0.78 SRD5A2 (0.50) SRD5A2ATMTDP1L3MBTL1VCAM1
SCHEMBL7813946 0.78 HAO1 (0.46) ARMRGPRX4SRD5A2L3MBTL1ALDH1A1
SCHEMBL7810316 0.77 VNN1 (0.51) ARMRGPRX4ATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891345-B1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF UNION PHARMA SCIENT APPL (FR) 2001-08-16 EP disclosed
CN-1215396-A Diarylmethylidene furan derivatives, preparation method and therapeutic use thereof UNION PHARMA SCIENT APPL (FR) 1999-04-28 CN disclosed