SCHEMBL14419368

SCHEMBL14419368

CBc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.51
▸ KMT2A Q03164 8/20 0.51
▸ CYP19A1 P11511 1/20 0.49
▸ ADORA1 P30542 2/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ ADORA2B P29275 1/20 0.45
▸ MCL1 Q07820 2/20 0.44
▸ RAB9A P51151 2/20 0.43
▸ MAPT P10636 4/20 0.43
▸ HPGD P15428 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ DHODH Q02127 2/20 0.42
▸ CTRC Q99895 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ ADORA2A P29274 1/20 0.42

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
SCHEMBL14307277 0.87 MEN1 (0.58) MEN1KMT2AADORA1ADORA3MAPT
SCHEMBL10051444 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL4404689 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL10051447 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL19860206 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL12258341 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL10051450 0.84 CYP19A1 (0.63) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL19526717 0.84 MEN1 (0.47) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL14425504 0.82 CYP19A1 (0.61) MEN1KMT2ACYP19A1ADORA1ADORA3
SCHEMBL18270316 0.82 CYP19A1 (0.61) MEN1KMT2ACYP19A1ADORA1ADORA3

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
EP-1829871-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT Pioneer Corporation (JP) 2007-09-05 — — EP disclosed
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