SCHEMBL18832668

SCHEMBL18832668

COc1ccc(C(=O)NC2(OC(=O)O)Cc3ccccc3C2)cc1CCOc1cccc(C)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 6/20 0.46
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GPR132 Q9UNW8 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL30262945 0.88 LPAR1 (0.59) LPAR1MAPTLMNATSHRMAPK1
SCHEMBL1560349 0.88 LPAR1 (0.59) LPAR1MAPTLMNATSHRMAPK1
SCHEMBL18832679 0.85 LPAR1 (0.48) LPAR1LMNASMN1; SMN2POLBMEN1
SCHEMBL18832654 0.83 LPAR1 (0.63) LPAR1
SCHEMBL18832675 0.78 LPAR1 (0.61) LPAR1MEN1KMT2AGPR132
SCHEMBL18832661 0.78 LPAR1 (0.60) LPAR1MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL18832673 0.78 LPAR1 (0.51) LPAR1MAPTLMNASMN1; SMN2L3MBTL1
SCHEMBL18832678 0.78 LPAR1 (0.63) LPAR1MAPTLMNAALDH1A1MEN1
SCHEMBL18832659 0.77 LPAR1 (0.44) LPAR1MAPTSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL18874187 0.77 LPAR1 (0.44) LPAR1MAPTTSHRSMN1; SMN2L3MBTL1

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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