SCHEMBL29618970

SCHEMBL29618970

CC1Cc2ccccc2N1N=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.53
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
HTR2A P28223 3/20 0.42
HTR2C P28335 3/20 0.42
HTR2B P41595 3/20 0.42
ALDH1A1 P00352 5/20 0.42
NPC1 O15118 2/20 0.42
PKM P14618 2/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
SLC22A12 Q96S37 1/20 0.41

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
SCHEMBL10892562 1.00 NOTUM (0.53) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL29618969 1.00 NOTUM (0.53) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL15187617 0.79 NOTUM (0.54) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL4633137 0.78 NOTUM (0.38) NOTUMLMNAMEN1KMT2AHTR2A
SCHEMBL15181290 0.74 DRD2 (0.41) NOTUMMEN1KMT2ACHRM2CHRM4
SCHEMBL3693710 0.73 NOTUM (0.41) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL31672940 0.72 NOTUM (0.55) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL6890897 0.72 NOTUM (0.55) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL14705297 0.72 NOTUM (0.55) NOTUMLMNAMEN1MAPTKMT2A
SCHEMBL7733992 0.72 NOTUM (0.55) NOTUMLMNAMEN1MAPTKMT2A

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-114594174-A Method for detecting impurity A in indapamide preparation 远大医药(中国)有限公司 2022-06-07 CN disclosed