SCHEMBL8742229

SCHEMBL8742229

NC1CC2C=CC1CCCCCCCCCCCCCCCCCCCCC2

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL23328042 0.83
SCHEMBL5598618 0.83
SCHEMBL18531368 0.81 THRB (0.35) THRBMEN1KMT2A
SCHEMBL1401426 0.72
SCHEMBL3123506 0.72
SCHEMBL1401428 0.72
SCHEMBL6774006 0.72 KDM4E (0.37)
Hydrochloric Acid SCHEMBL7189757 0.70
Hydrochloric Acid SCHEMBL7189752 0.70
SCHEMBL4409148 0.68

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
US-5624941-A Pyrazole derivatives, method of preparing them and pharmaceutical compositions in which they are present SANOFI (FR) 1997-04-29 US disclosed