SCHEMBL31361077

SCHEMBL31361077

Cc1cccnc1Nc1cc(Cl)nc(Cl)c1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 4/20 0.46
NPC1 O15118 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.41
TP53 P04637 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
BLM P54132 1/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 2/20 0.40
AHR P35869 1/20 0.40
KDM4E B2RXH2 1/20 0.40
DHODH Q02127 1/20 0.40
HTT P42858 3/20 0.40
ATM Q13315 1/20 0.39

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
SCHEMBL31361068 0.85 ALDH1A1 (0.44) RAB9AALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL31361067 0.76 CXCR2 (0.44) ALDH1A1HPGDMAPTPOLBMEN1
SCHEMBL10168708 0.76 CXCR2 (0.44) ALDH1A1HPGDMAPTPOLBMEN1
SCHEMBL31361069 0.76 CXCR2 (0.44) ALDH1A1HPGDMAPTPOLBMEN1
SCHEMBL31361062 0.75 POLB (0.38) RAB9AALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL28530643 0.74 POLB (0.38) RAB9AALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL30544155 0.74 POLB (0.38) RAB9AALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL31361070 0.72 GCK (0.41) RAB9AALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL26534099 0.72 RAB9A (0.43) RAB9AALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL2094424 0.70 POLB (0.72) ALDH1A1HPGDSMN1; SMN2MAPTPOLB

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-119176820-A Tricyclic compounds as MAT2A inhibitors 艾立康药业股份有限公司 2024-12-24 CN disclosed