SCHEMBL29539050

SCHEMBL29539050

COc1cc2c(cc1C1CC1C(=O)O)-c1c(c(C(=O)N(C)C(C)(C)C)nn1-c1cc(Cl)cc(Cl)c1)CO2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 3/20 0.34
▸ FFAR1 O14842 1/20 0.31
▸ LTC4S Q16873 1/20 0.31

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
SCHEMBL17381975 1.00 NR1H4 (0.34) NR1H4FFAR1LTC4S
SCHEMBL20988692 1.00 NR1H4 (0.34) NR1H4FFAR1LTC4S
SCHEMBL19325985 1.00 NR1H4 (0.34) NR1H4FFAR1LTC4S
SCHEMBL17381976 1.00 NR1H4 (0.34) NR1H4FFAR1LTC4S
SCHEMBL17381974 1.00 NR1H4 (0.34) NR1H4FFAR1LTC4S
SCHEMBL17381642 0.93 NR1H4 (0.32) NR1H4
SCHEMBL17382405 0.93 NR1H4 (0.32) NR1H4
SCHEMBL17381558 0.93 NR1H4 (0.32) NR1H4
SCHEMBL17381973 0.93 NR1H4 (0.32) NR1H4
SCHEMBL19325984 0.93 NR1H4 (0.32) NR1H4

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-106573937-B Pyrazole compounds as FSHR modulators and uses thereof 阿瑞斯贸易股份公司 2022-02-11 — — CN disclosed
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