SCHEMBL28241024

SCHEMBL28241024

CCCPc1ccccc1CN

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PNMT P11086 3/20 0.39
DPP4 P27487 2/20 0.36
TAAR1 Q96RJ0 1/20 0.32
NCF1 P14598 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CSNK2A3 Q8NEV1 1/20 0.30
LOXL2 Q9Y4K0 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
SCHEMBL27948017 0.89 PNMT (0.36) PNMTDPP4TAAR1
SCHEMBL28240126 0.87 LIPG (0.36) PNMTDPP4
SCHEMBL27932083 0.85 LIPG (0.39) PNMTDPP4
SCHEMBL28240120 0.85 LIPG (0.39) PNMTDPP4
SCHEMBL6682709 0.83 GABRA1 (0.38)
SCHEMBL27932054 0.83 PNMT (0.41) PNMTDPP4TAAR1NCF1SLC6A2
SCHEMBL7902242 0.80 TP53 (0.33)
SCHEMBL28240930 0.78 LIPG (0.42)
SCHEMBL3388879 0.74 GABRA1 (0.41)
SCHEMBL28806910 0.74 PNMT (0.44) PNMTDPP4TAAR1NCF1SLC6A2

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
CN-105754099-B Composition and polymer 旭化成株式会社 2018-09-18 CN disclosed