SCHEMBL8936783

SCHEMBL8936783

Cn1nnc2ccc(Oc3ccc(Cl)cc3Cn3ccnc3)cc21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP19A1 P11511 5/20 0.43
FNTA P49354 4/20 0.42
FNTB P49356 4/20 0.42
PGGT1B P53609 4/20 0.42
ALDH1A1 P00352 2/20 0.40
TBXAS1 P24557 2/20 0.40
SLC6A4 P31645 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
CYP2B6 P20813 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
SCHEMBL8936722 0.82 CYP19A1 (0.46) MEN1KMT2ACYP19A1ALDH1A1SLC6A4
SCHEMBL9194951 0.78 FNTA (0.56) MEN1KMT2ACYP19A1FNTAFNTB
SCHEMBL8936690 0.75 MEN1 (0.47) MEN1KMT2ACYP19A1FNTAFNTB
SCHEMBL8936764 0.74 NLRP3 (0.40) MEN1KMT2ACYP19A1ALDH1A1SLC6A4
SCHEMBL9201316 0.74 CYP19A1 (0.46) CYP19A1SLC6A4CYP11B1
SCHEMBL9707231 0.73 CYP11B1 (0.51) CYP19A1ALDH1A1TBXAS1CYP2A6CYP11B1
SCHEMBL8936726 0.71 ALDH1A1 (0.47) MEN1KMT2ACYP19A1FNTAFNTB
SCHEMBL9204708 0.71 CYP19A1 (0.44) MEN1KMT2ACYP19A1ALDH1A1SLC6A4
SCHEMBL8936731 0.71 NLRP3 (0.39) CYP19A1SLC6A4CYP11B1
SCHEMBL9201287 0.70 CYP19A1 (0.39) MEN1KMT2ACYP19A1ALDH1A1CYP11B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587392-A THERAPY FOR ESTROGEN DEPENDENT DISEASES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed
EP-0684235-A1 Novel azolyl methyl phenyl derivatives having aromatase inhibitory activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-11-29 EP disclosed