SCHEMBL31111404

SCHEMBL31111404

N#Cc1c(Cl)ncc(C=O)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.34
MEN1 O00255 5/20 0.34
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPT P10636 4/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 3/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BCL6 P41182 3/20 0.32
TDP1 Q9NUW8 2/20 0.31
CHEK1 O14757 1/20 0.31
AURKA O14965 1/20 0.31
CDK2 P24941 1/20 0.31
FLT4 P35916 1/20 0.31
FLT3 P36888 1/20 0.31
MAPKAPK2 P49137 1/20 0.31
GSK3A P49840 1/20 0.31

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
SCHEMBL8544979 1.00 KMT2A (0.34) KMT2AMEN1HPGDPOLBALOX12
SCHEMBL8548916 0.76 ALDH1A1 (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2TDP1
SCHEMBL19971159 0.76 ERN1 (0.33) KMT2AMEN1MAPTALDH1A1CYP3A4
SCHEMBL845675 0.74
SCHEMBL846768 0.73 KDM4E (0.30) HPGDALDH1A1KDM4E
SCHEMBL846767 0.73 KDM4E (0.30) HPGDALDH1A1KDM4E
SCHEMBL8548155 0.72 ALDH1A1 (0.33) KMT2AMEN1MAPTALDH1A1CYP3A4
SCHEMBL8545018 0.72 ADORA1 (0.41) KMT2AMEN1HPGDPOLBMAPT
SCHEMBL15434050 0.71 CYP1A2 (0.38) KMT2AMEN1MAPTALDH1A1CYP3A4
SCHEMBL1413327 0.71 KMT2A (0.36) KMT2AMEN1HPGDPOLBALOX12

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
CN-119285572-A Kinase inhibitors and uses thereof 戴纳立制药公司 2025-01-10 CN disclosed
CN-119264073-A Kinase inhibitors and uses thereof 戴纳立制药公司 2025-01-07 CN disclosed
CN-110913858-B Kinase inhibitors and uses thereof 戴纳立制药公司 2024-09-24 CN disclosed