SCHEMBL29634906

SCHEMBL29634906

O=c1c2c(CBr)c(-c3ccc([N+](=O)[O-])cc3)sc2n(Cc2c(F)cccc2F)c(=O)n1C1CCS(=O)(=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.55

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
SCHEMBL29634925 0.90 GNRHR (0.69) GNRHR
SCHEMBL29634859 0.90 GNRHR (0.54) GNRHR
SCHEMBL29634892 0.90 GNRHR (0.56) GNRHR
SCHEMBL4253774 0.81 GNRHR (0.80) GNRHR
SCHEMBL29634938 0.80 GNRHR (0.68) GNRHR
SCHEMBL29634887 0.79 GNRHR (0.54) GNRHR
SCHEMBL29634916 0.79 GNRHR (0.60) GNRHR
SCHEMBL29385627 0.76 GNRHR (0.61) GNRHR
SCHEMBL29696471 0.75 GNRHR (0.61) GNRHR
SCHEMBL29696401 0.75 GNRHR (0.57) GNRHR

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-111875614-B Heterocyclyl-substituted thieno [2,3-d ] pyrimidine-2, 4(1H,3H) -diones and their use 东莞市东阳光新药研发有限公司 2022-04-29 CN disclosed