SCHEMBL11209866

SCHEMBL11209866

O=Cc1ccc(CCCCCCCCC(=O)O)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.59
LMNA P02545 2/20 0.59
ALDH1A1 P00352 1/20 0.59
PRNP P04156 1/20 0.59
RECQL P46063 1/20 0.59
POLB P06746 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MAPT P10636 1/20 0.46
LTB4R Q15722 4/20 0.43
F13A1 P00488 3/20 0.42
HPGD P15428 1/20 0.41
RPS6KB2 Q9UBS0 1/20 0.41
EPHX2 P34913 1/20 0.40
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39
TBXAS1 P24557 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL11251999 1.00 RXFP1 (0.59) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11206865 1.00 RXFP1 (0.59) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11210208 1.00 RXFP1 (0.59) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11205241 1.00 RXFP1 (0.59) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11210650 0.98 RXFP1 (0.56) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11251729 0.93 RXFP1 (0.50) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL9794742 0.86 RPS6KB2 (0.43) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL12664443 0.84 ALDH1A1 (0.41) ALDH1A1POLBMAPT
SCHEMBL20391283 0.84 ALDH1A1 (0.41) RXFP1LMNAALDH1A1PRNPRECQL
SCHEMBL11235323 0.82 HPGD (0.64) RXFP1LMNAALDH1A1PRNPRECQL

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-0029247-B1 ALKENYL THIENYL ALKANE CARBOXYLIC ACIDS AND THEIR DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1983-04-13 EP disclosed
US-4309407-A ANTIINFLAMMATORY, ANTIPYRETIC, ANTI-ARTERIOSCLEROTIC A. NATTERMANN & CIE. GMBH (DE) 1982-01-05 US disclosed
EP-0029247-A1 Alkenyl thienyl alkane carboxylic acids and their derivatives, process for their preparation and medicaments containing them A. Nattermann & Cie. GmbH (DE) 1981-05-27 EP disclosed