SCHEMBL11245207

SCHEMBL11245207

CC(C)c1cc(Cl)c(O)c(C(=O)OC(=O)c2cc(C(C)(C)C)cc(Cl)c2OC(=O)c2cc(C(C)C)cc(Cl)c2O)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 2/20 0.35
AKR1C1 Q04828 2/20 0.35
ACLY P53396 1/20 0.32
NR1H4 Q96RI1 1/20 0.30

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
SCHEMBL11245205 0.91 AKR1C2 (0.43) AKR1C2AKR1C1NR1H4
SCHEMBL11245202 0.79 AKR1C2 (0.55) AKR1C2AKR1C1ACLY
SCHEMBL11228742 0.67 AKR1C2 (0.58) AKR1C2AKR1C1
SCHEMBL9247751 0.67 AKR1C2 (0.67) AKR1C2AKR1C1ACLYNR1H4
SCHEMBL28205302 0.65 GALK1 (0.47)
SCHEMBL6337833 0.64 NR5A2 (0.43)
SCHEMBL9740619 0.63 AKR1C2 (0.47) AKR1C2AKR1C1ACLYNR1H4
SCHEMBL13801377 0.62 HSD17B10 (0.64)
SCHEMBL6321695 0.62 GABRA1 (0.52) AKR1C2AKR1C1ACLY
SCHEMBL4866477 0.62 NR5A2 (0.46)

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
US-4355070-A COLOR FORMER, DEVELOPER, HEAT FUSIBLE MATERIAL AND OIL ABSORPTIVE PIGMENT KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1982-10-19 US disclosed
US-4236732-A COLOR DEVELOPING LAYER CONTAINING PARTICLES OF A CHROMOGENIC MATERIAL, AN ACCEPTOR AND A HEAT FUSIBLE MATERIAL KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1980-12-02 US disclosed
US-4228222-A COLOR DEVELOPING LAYER INCLUDING WATER SOLUBLE RESIN AS BINDER KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1980-10-14 US disclosed