SCHEMBL8090148

SCHEMBL8090148

[c]1ccsc1-c1ncccn1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 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
SCHEMBL4576900 0.75 KDM4E (0.48) CYP19A1
SCHEMBL8635960 0.71 PDPK1 (0.42)
SCHEMBL8096621 0.67 CYP1A2 (0.35) CYP19A1
SCHEMBL7832259 0.66
SCHEMBL2782543 0.65 CYP2E1 (0.39)
SCHEMBL8094323 0.65 CYP1A2 (0.46)
SCHEMBL28018590 0.62
SCHEMBL171853 0.61 HDAC8 (0.47)
SCHEMBL11525040 0.60 ALDH1A1 (0.41) CYP19A1
SCHEMBL1671362 0.59 CYP2A6 (0.30)

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-6063956-A APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS WHERE CONTROL IS DESIRED ROHM AND HAAS COMPANY (US) 2000-05-16 US disclosed