SCHEMBL22092989

SCHEMBL22092989

CC(N)Cc1ncccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 5/20 0.44
▸ TAAR1 Q96RJ0 4/20 0.44
▸ SLC6A3 Q01959 3/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ MAOA P21397 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44
▸ CYP2A6 P11509 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ ADORA1 P30542 1/20 0.44
▸ HRH4 Q9H3N8 2/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.38
▸ HTR2A P28223 2/20 0.38
▸ HTR2C P28335 2/20 0.38
▸ HTR2B P41595 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PNMT P11086 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38

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
SCHEMBL2948062 0.79 KDM4E (0.39) SLC6A2ALDH1A1CYP1A2
SCHEMBL9035682 0.75 KDM4E (0.30) —
SCHEMBL18647938 0.75 TRPA1 (0.31) HTR2AHTR2CHTR2B
SCHEMBL15255480 0.75 LMNA (0.35) MEN1ALDH1A1KMT2ACYP1A2
SCHEMBL9032539 0.73 GRIN2D (0.34) —
SCHEMBL24454696 0.73 GRIN2D (0.61) SLC6A2TAAR1SLC6A3SLC6A4MAOA
SCHEMBL702426 0.73 GRIN2D (0.61) SLC6A2TAAR1SLC6A3SLC6A4MAOA
SCHEMBL14478286 0.73 GRIN2D (0.61) SLC6A2TAAR1SLC6A3SLC6A4MAOA
SCHEMBL12894962 0.73 GRIN2D (0.61) SLC6A2TAAR1SLC6A3SLC6A4MAOA
SCHEMBL20279226 0.73 P2RX7 (0.33) —

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
EP-3894396-A1 2-OXOQUINAZOLINE DERIVATIVES AS METHIONINE ADENOSYLTRANSFERASE 2A INHIBITORS Ideaya Biosciences, Inc. (US) 2021-10-20 — — EP disclosed
WO-2020123395-A1 2-OXOQUINAZOLINE DERIVATIVES AS METHIONINE ADENOSYLTRANSFERASE 2A INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2020-06-18 — — WO disclosed
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