SCHEMBL7559353

SCHEMBL7559353

CC1(C)Cc2c(-c3ccccc3)ccn2C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.36
PTGS1 P23219 3/20 0.36
PTGES O14684 2/20 0.36
ALOX5AP P20292 1/20 0.36
PTGS2 P35354 1/20 0.36
LMNA P02545 2/20 0.35
RAB9A P51151 1/20 0.33

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
SCHEMBL24035529 0.67 TGFBR1 (0.38)
SCHEMBL9267895 0.66 NPC1 (0.36) ALOX5PTGS1PTGESALOX5APPTGS2
SCHEMBL1127461 0.63 PTGS2 (0.42) ALOX5PTGS1PTGS2
SCHEMBL28304521 0.57 ALDH1A1 (0.52) PTGS2
SCHEMBL4331066 0.57 ALDH1A1 (0.42) LMNARAB9A
SCHEMBL9458564 0.55 ALDH1A1 (0.49) PTGS2LMNARAB9A
SCHEMBL23561017 0.55 GRM5 (0.54) RAB9A
SCHEMBL29279313 0.54 ALDH1A1 (0.44) LMNARAB9A
SCHEMBL8041604 0.54 TSHR (0.50) LMNARAB9A
Biphenyl SCHEMBL2521582 0.54 ALDH1A1 (0.75) LMNARAB9A

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
CN-1266152-C Method for the production of 6-(4-chlorophenyl)-2,2-dimethyl-7-phenyl-2,3-dihydro-1h-pyrrolizin-5-ylacetic acid MERCKLE GMBH (DE) 2006-07-26 CN disclosed
CN-1545516-A Process for producing 6- (4-chlorophenyl) -2, 2-dimethyl-7-phenyl-2, 3-dihydro-1H-pyrrolizin-5-ylacetic acid ��Ĭ���� 2004-11-10 CN disclosed
WO-2001005792-A9 ANTI-INFLAMMATORY OXO DERIVATIVES AND HYDROXY DERIVATIVES OF PYRROLIZINES, AND THEIR PHARMACEUTICAL USE MERCKLE GMBH (DE) 2002-08-29 WO disclosed