SCHEMBL7968757

SCHEMBL7968757

COc1ccc(N(C(C)=O)c2ccccn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
KDM4E B2RXH2 2/20 0.51
TRPM8 Q7Z2W7 6/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
NPC1 O15118 3/20 0.47
PKM P14618 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 2/20 0.47
F2 P00734 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45

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
SCHEMBL8893391 0.87 KDM4E (0.50) POLBKDM4ETRPM8MEN1KMT2A
SCHEMBL7978882 0.85 TP53 (0.49) TRPM8MEN1KMT2ATSHRNPC1
SCHEMBL19512684 0.84 NPSR1 (0.47) POLBKDM4EMEN1KMT2ATSHR
SCHEMBL7982461 0.83 ALDH1A1 (0.48) POLBKDM4ETRPM8MEN1KMT2A
SCHEMBL7982503 0.82 S100A4 (0.48) POLBKDM4EMEN1KMT2ATSHR
SCHEMBL229105 0.81 HTT (0.53) POLBKDM4EMEN1KMT2ATSHR
SCHEMBL7968760 0.79 MEN1 (0.58) POLBKDM4ETRPM8MEN1KMT2A
SCHEMBL31393785 0.79 KMT2A (0.66) POLBKDM4ETRPM8MEN1KMT2A
SCHEMBL6340651 0.79 HTT (0.47) POLBKDM4EMEN1KMT2ATSHR
SCHEMBL28332018 0.79 POLB (0.55) POLBTRPM8MEN1KMT2ATSHR

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
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed