SCHEMBL7865373

SCHEMBL7865373

COc1cccc(OC)c1C(=O)c1cccc(P)c1C(=O)c1c(OC)cccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CTSD P07339 1/20 0.40
HTT P42858 1/20 0.40
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
KCNB1 Q14721 1/20 0.39
TP53 P04637 1/20 0.38
STAT3 P40763 1/20 0.38
NPC1 O15118 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL11755425 0.82 CA1 (0.71) CA12CA1CA2CA7CA9
Phosphine SCHEMBL22468662 0.81 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL23361672 0.81 CA1 (0.52) CA12CA1CA2CA7CA9
SCHEMBL28516342 0.79 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL346600 0.78 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL5144086 0.76 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL28210985 0.76 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL9515912 0.74 ALDH1A1 (0.45) NPC1
SCHEMBL247465 0.73 KMT2A (0.43) KDM4EHSD17B10
SCHEMBL28315313 0.73 KMT2A (0.53) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4238769-A1 INK COMPOSITION DNP Fine Chemicals Co., Ltd. (JP) 2023-09-06 EP disclosed
EP-1135399-A1 PROCESS FOR PREPARING ACYLPHOSPHINES AND DERIVATIVES Ciba SC Holding AG (CH) 2001-09-26 EP disclosed
WO-2000032612-A1 PROCESS FOR PREPARING ACYLPHOSPHINES AND DERIVATIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-06-08 WO disclosed