SCHEMBL30633570

SCHEMBL30633570

CNC(=O)Nc1cccnc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.68
NPC1 O15118 5/20 0.68
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
ALDH1A1 P00352 2/20 0.62
HTT P42858 2/20 0.62
KDM4E B2RXH2 1/20 0.62
LMNA P02545 3/20 0.61
MAPT P10636 3/20 0.61
CDK2 P24941 1/20 0.61
FLT4 P35916 1/20 0.61
PKM P14618 2/20 0.61
TSHR P16473 1/20 0.59
TAAR1 Q96RJ0 1/20 0.59
ATM Q13315 1/20 0.59
HIF1A Q16665 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.58
AHR P35869 1/20 0.57
CYP1A2 P05177 1/20 0.57

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
SCHEMBL7785654 1.00 RAB9A (0.68) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL9637653 0.88 MEN1 (0.77) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL30051982 0.88 MEN1 (0.77) RAB9ANPC1MEN1KMT2AALDH1A1
Bromide SCHEMBL29417998 0.86 MEN1 (0.74) RAB9ANPC1MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL29388210 0.86 MEN1 (0.74) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL12120402 0.86 RAB9A (0.64) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL10756618 0.84 RAB9A (0.54) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL10857079 0.84 RAB9A (0.57) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL10665495 0.83 RAB9A (0.79) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL5633303 0.81 RAB9A (0.63) RAB9ANPC1MEN1KMT2AALDH1A1

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-117043162-A TYK2 selective inhibitors and uses thereof 迈巴制药(南京)有限公司 2023-11-10 CN disclosed