SCHEMBL27415476

SCHEMBL27415476

NCc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(N)c3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ MAPT P10636 3/20 0.59
▸ HPGD P15428 3/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ GLA P06280 1/20 0.59
▸ TAAR1 Q96RJ0 3/20 0.55
▸ MAOA P21397 1/20 0.50
▸ CYP19A1 P11511 2/20 0.48
▸ CYP17A1 P05093 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP11B1 P15538 1/20 0.48
▸ CYP11B2 P19099 1/20 0.48
▸ FYN P06241 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ADORA2A P29274 1/20 0.43
▸ ADORA1 P30542 1/20 0.43

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
SCHEMBL27408485 0.91 TAAR1 (0.58) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL28110796 0.91 TAAR1 (0.67) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL28196228 0.91 TAAR1 (0.67) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL15684033 0.89 MEN1 (0.73) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL14389682 0.87 MEN1 (0.70) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16871023 0.84 MEN1 (0.70) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL8480067 0.83 MEN1 (0.69) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL28135501 0.83 TAAR1 (0.56) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL27416185 0.81 CTRC (0.54) TAAR1
SCHEMBL3787922 0.80 TAAR1 (0.64) MEN1TAAR1MAOACYP19A1CYP17A1

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
CN-1087015-C Pyridine derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 2002-07-03 — — CN disclosed
CN-1169721-A Pyridine derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1998-01-07 — — CN disclosed
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