SCHEMBL24704166

SCHEMBL24704166

N#CC=C(c1ccccn1)c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.50
NPC1 O15118 6/20 0.50
PKM P14618 2/20 0.50
POLB P06746 1/20 0.50
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
EGFR P00533 1/20 0.46
IGF1R P08069 1/20 0.46
IGF2R P11717 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.45
LMNA P02545 4/20 0.45
NAPRT Q6XQN6 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 5/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
MITF O75030 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 0.89 RAB9A (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL10620307 0.89 RAB9A (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL24704170 0.89 RAB9A (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL8999123 0.84 KMT2A (0.53) RAB9ANPC1PKMPOLBCES1
SCHEMBL8999119 0.84 KMT2A (0.53) RAB9ANPC1PKMPOLBCES1
SCHEMBL5026300 0.81 MAPK1 (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL5022890 0.81 MAPK1 (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL29078723 0.81 MAPK1 (0.49) RAB9ANPC1PKMPOLBCES2
SCHEMBL7550447 0.80 KDM1A (0.40) RAB9ANPC1PKMPOLBEGFR
SCHEMBL7550449 0.80 KDM1A (0.40) RAB9ANPC1PKMPOLBEGFR

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-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