SCHEMBL21730346

SCHEMBL21730346

CC/C=C\c1ncc(C)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 1/20 0.30

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
SCHEMBL18272516 0.65 — —
SCHEMBL2282179 0.63 — —
SCHEMBL24435071 0.61 CCR1 (0.43) —
SCHEMBL10193818 0.61 HDAC1 (0.36) —
SCHEMBL18272556 0.61 — —
SCHEMBL20708295 0.60 CHRNB2 (0.36) —
SCHEMBL20613110 0.60 — —
SCHEMBL12507912 0.60 NOS1 (0.39) —
SCHEMBL10021906 0.60 SMPD3 (0.48) —
SCHEMBL24386529 0.60 CYP3A4 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020035052-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2020-02-20 — — WO disclosed
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