SCHEMBL28536609

SCHEMBL28536609

O=C(Nc1c(F)cnn1-c1ccc(-c2ccc(C3(C(=O)O)CC3)cc2)cc1)OCCc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 20/20 0.46
LPAR3 Q9UBY5 7/20 0.44
HRH1 P35367 1/20 0.44

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
SCHEMBL28541547 0.92 APP (0.45) LPAR1LPAR3
SCHEMBL28536018 0.92 LPAR1 (0.40) LPAR1LPAR3HRH1
SCHEMBL28911001 0.90 LPAR1 (0.49) LPAR1LPAR3HRH1
SCHEMBL28531078 0.88 LPAR1 (0.42) LPAR1LPAR3HRH1
SCHEMBL28551532 0.85 LPAR1 (0.39) LPAR1LPAR3HRH1
SCHEMBL28536614 0.84 LPAR1 (0.46) LPAR1LPAR3HRH1
SCHEMBL16059892 0.82 LPAR1 (0.67) LPAR1LPAR3HRH1
SCHEMBL16059891 0.82 LPAR1 (0.67) LPAR1LPAR3HRH1
SCHEMBL28541603 0.80 APP (0.46) LPAR1LPAR3HRH1
SCHEMBL28538238 0.78 MGLL (0.42) LPAR1LPAR3HRH1

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
CN-112424174-A Heterocyclic compounds useful for the treatment of diseases 艾匹根生物技术有限公司 2021-02-26 CN claimed