SCHEMBL10620307

SCHEMBL10620307

N#C/C=C(/c1ccccc1)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49
PKM P14618 2/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 3/20 0.49
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 3/20 0.44
NAPRT Q6XQN6 1/20 0.44
P4HTM Q9NXG6 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.42
EGFR P00533 1/20 0.42

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
SCHEMBL10620312 1.00 RAB9A (0.49) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL24704170 1.00 RAB9A (0.49) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL24704166 0.89 RAB9A (0.50) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL8999119 0.87 KMT2A (0.53) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL8999123 0.87 KMT2A (0.53) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL7550449 0.84 KDM1A (0.40) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL7550447 0.84 KDM1A (0.40) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL24704160 0.82 PDE4A (0.44) POLBKMT2APDE4APDE4BPDE4C
SCHEMBL24704156 0.82 PDE4A (0.44) RAB9ANPC1PKMPOLBKMT2A
SCHEMBL7547009 0.81 PDE4A (0.64) RAB9ANPC1PKMKMT2APDE4A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63051372-A None JP disclosed
WO-2022255228-A1 COMPOSITION, CURED PRODUCT OR COMPACT, OPTICAL MEMBER, AND LENS 富士フイルム株式会社 2022-12-08 WO disclosed
JP-S6351372-A PRODUCTION OF 3-PHENYL-3-(2-PYRIDYL)ACRYLONITRILE MITSUBISHI CHEM IND LTD 1988-03-04 JP disclosed