SCHEMBL9817016

SCHEMBL9817016

CC(C)(C)c1cc(Cc2cc(Cc3ccccc3)c(O)c(C(C)(C)C)c2)cc(Cc2ccccc2)c1O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 2/20 0.60
▸ PTPN1 P18031 2/20 0.55
▸ PTPN2 P17706 1/20 0.55
▸ PTPN6 P29350 1/20 0.55
▸ BCL2 P10415 1/20 0.52
▸ BCL2L1 Q07817 1/20 0.52
▸ CYP2C9 P11712 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ HIF1A Q16665 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ DHFR P00374 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL12430324 0.97 HSPA5 (0.65) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL11352569 0.90 HSPA5 (0.76) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL1187217 0.90 MEN1 (0.57) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL4565241 0.90 HSPA5 (0.64) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL9475140 0.88 HSPA5 (0.70) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL4459522 0.85 HSPA5 (0.72) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL7110304 0.85 CYP2C9 (0.52) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL9131704 0.85 HSPA5 (0.48) HSPA5PTPN1PTPN2PTPN6BCL2
SCHEMBL39543 0.84 HSPA5 (0.65) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL11248433 0.84 HSPA5 (0.76) HSPA5CYP2C9CYP2C19HIF1ASMN1; SMN2

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
EP-0453317-A2 Image forming medium CANON KABUSHIKI KAISHA (JP) 1991-10-23 — — EP disclosed
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