SCHEMBL31314537

SCHEMBL31314537

COc1ccc(-c2cc(=O)n3nc(Cl)ccc3n2)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.53
MAPT P10636 7/20 0.51
RAB9A P51151 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
HSD17B10 Q99714 3/20 0.51
TSHR P16473 3/20 0.51
FUBP1 Q96AE4 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
PIK3CG P48736 1/20 0.48
MAPK1 P28482 3/20 0.47
NPC1 O15118 2/20 0.47
PKM P14618 2/20 0.47
BRD4 O60885 1/20 0.47
ALOX15 P16050 1/20 0.47
NFKB1 P19838 1/20 0.47
HTT P42858 1/20 0.47
NFKB2 Q00653 1/20 0.47

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
SCHEMBL15175758 1.00 TP53 (0.53) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL18337079 0.77 KDM4E (0.47) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL15176266 0.75 FYN (0.45) TP53MAPTFUBP1TDP1PIK3CG
SCHEMBL3513641 0.73 FYN (0.74) FYN
SCHEMBL12953045 0.73 PIK3CG (0.67) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL15176064 0.72 MAPT (0.50) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL30602254 0.72 SMN1; SMN2 (0.54) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL15176054 0.72 SMN1; SMN2 (0.54) TP53MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL15174228 0.72 FYN (0.41) TP53MAPTTSHRFUBP1TDP1
SCHEMBL10690765 0.72 KDM4E (0.61) TP53MAPTRAB9ASMN1; SMN2KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119528903-A Compounds for the treatment of spinal muscular atrophy PTC医疗公司 2025-02-28 CN disclosed
CN-108299314-B Compounds for the treatment of spinal muscular atrophy PTC医疗公司 2024-11-26 CN disclosed