SCHEMBL9251114

SCHEMBL9251114

CCCCCC(C)(C)c1cc(Cl)cc(C(=O)O)c1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
AKR1C2 P52895 3/20 0.45
AKR1C1 Q04828 3/20 0.45
AKR1C4 P17516 1/20 0.45
AKR1C3 P42330 1/20 0.45
CNR2 P34972 7/20 0.38
CNR1 P21554 6/20 0.38
KAT8 Q9H7Z6 2/20 0.37
PPARA Q07869 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
CISD1 Q9NZ45 1/20 0.36
SCN5A Q14524 2/20 0.35
SCN9A Q15858 2/20 0.35

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
SCHEMBL1129615 0.84 NR5A2 (0.45) CNR2CNR1NR5A2NR5A1
SCHEMBL9253322 0.84 CNR2 (0.44) ALDH1A1CNR2CNR1KAT8PPARA
SCHEMBL11778832 0.84 KAT8 (0.39) AKR1C2AKR1C1CNR2CNR1KAT8
SCHEMBL9249781 0.84 AKR1C2 (0.51) ALDH1A1HPGDHSD17B10AKR1C2AKR1C1
SCHEMBL3015095 0.83 CNR2 (0.46) CNR2CNR1NR5A2NR5A1
SCHEMBL3008817 0.83 CNR2 (0.46) CNR2CNR1NR5A2NR5A1
SCHEMBL9615392 0.83 CNR2 (0.46) CNR2CNR1KAT8PPARA
SCHEMBL9249769 0.83 KAT8 (0.43) AKR1C2AKR1C1CNR2CNR1KAT8
SCHEMBL9251112 0.82 AKR1C2 (0.50) ALDH1A1HPGDHSD17B10AKR1C2AKR1C1
SCHEMBL9615358 0.82 NR5A2 (0.52) AKR1C2AKR1C1CNR2CNR1KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0338808-B1 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INT INC (US) 1995-08-23 EP disclosed
US-5017546-A Metallized phenolic resins SCHENECTADY INTERNATIONAL, INC. 1991-05-21 US disclosed
US-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed
EP-0338808-A2 Alkyl salicylate resin for carbonless copy paper and imaging use SCHENECTADY INTERNATIONAL, INC. (US) 1989-10-25 EP disclosed
US-4134847-A HOMOGENIZING AN AROMATIC CARBOXYLIC ACID-POLYMER-METAL CARBONATE OR OXIDE MELT KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1979-01-16 US disclosed
US-4046941-A PRESSURE SENSITIVE COPYING SANKO CHEMICAL COMPANY LTD. (JA) 1977-09-06 US disclosed