SCHEMBL18832664

SCHEMBL18832664

Cc1cccc(CCOc2cc(C(=O)NC3(OC(=O)O)Cc4ccccc4C3)ccc2C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 5/20 0.58
▸ HSP90AA1 P07900 1/20 0.37
▸ HSP90AB1 P08238 1/20 0.37
▸ MRGPRX4 Q96LA9 3/20 0.35
▸ GPR132 Q9UNW8 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ NR1H4 Q96RI1 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KCNK3 O14649 1/20 0.33
▸ KCNK9 Q9NPC2 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
SCHEMBL1560997 0.88 LPAR1 (0.74) LPAR1GPR132
SCHEMBL18832675 0.87 LPAR1 (0.61) LPAR1HSP90AA1HSP90AB1GPR132NPC1
SCHEMBL18832654 0.87 LPAR1 (0.63) LPAR1NPC1RAB9A
SCHEMBL18832663 0.87 LPAR1 (0.43) LPAR1HPGDMAPTLMNA
SCHEMBL18832662 0.86 LPAR1 (0.60) LPAR1HSP90AA1HSP90AB1GPR132NPC1
SCHEMBL18832661 0.86 LPAR1 (0.60) LPAR1MAPTLMNASMN1; SMN2
SCHEMBL18832657 0.86 LPAR1 (0.79) LPAR1HSP90AA1HSP90AB1GPR132NPC1
SCHEMBL1561380 0.86 LPAR1 (0.63) LPAR1HSP90AA1HSP90AB1MRGPRX4GPR132
SCHEMBL18832658 0.85 LPAR1 (0.58) LPAR1MRGPRX4GPR132NPC1RAB9A
SCHEMBL18832667 0.83 LPAR1 (0.53) LPAR1GPR132HPGDSIRT2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2303270-B1 ACYLAMINO-SUBSTITUTED FUSED CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2017-05-17 — — EP claimed
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