SCHEMBL9872640

SCHEMBL9872640

Clc1cc[c]c(-n2ncnn2)c1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.35

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
SCHEMBL16054650 0.79
SCHEMBL9872221 0.79
SCHEMBL9872904 0.75
SCHEMBL30882298 0.65 MASP2 (0.37) CYP19A1
SCHEMBL5141456 0.64 ALDH1A1 (0.31)
SCHEMBL11667334 0.63 IDO1 (0.51) CYP19A1
SCHEMBL29193568 0.62 RAB9A (0.43)
SCHEMBL8755515 0.62
SCHEMBL30882563 0.61 P2RX3 (0.36) CYP19A1
SCHEMBL1173196 0.61

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-5073574-A TETRAZOLYL SUBSTITUTED BENZONITRILES AND ANTI-TUMOR USE THEREOF CIBA-GEIGY CORPORATION (US) 1991-12-17 US disclosed