SCHEMBL31743832

SCHEMBL31743832

O=c1[nH]c2ccc(Cl)cc2n1-c1ccc(N2CCOCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.60
▸ DAO P14920 1/20 0.51
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MAP2 P11137 1/20 0.48
▸ MAT2A P31153 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ AURKA O14965 1/20 0.46
▸ CASP1 P29466 1/20 0.45
▸ HTT P42858 1/20 0.44
▸ OPRM1 P35372 1/20 0.44

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
SCHEMBL31744130 0.86 TSHR (0.47) TSHRDAOMEN1KMT2ALMNA
SCHEMBL31743982 0.85 PHGDH (0.56) TSHRDAOMEN1KMT2ALMNA
SCHEMBL11348908 0.84 LMNA (0.62) TSHRDAOMEN1KMT2ALMNA
SCHEMBL31744058 0.84 DAO (0.48) TSHRDAOMEN1KMT2ALMNA
SCHEMBL8886284 0.79 MEN1 (0.77) DAOMEN1KMT2ALMNAL3MBTL1
SCHEMBL31743953 0.79 MEN1 (0.77) DAOMEN1KMT2ALMNAL3MBTL1
SCHEMBL31743945 0.78 MEN1 (0.44) TSHRDAOMEN1KMT2ALMNA
SCHEMBL31743856 0.78 KMT2A (0.44) TSHRDAOMEN1KMT2ALMNA
SCHEMBL31743751 0.77 SMN1; SMN2 (0.50) TSHRDAOMEN1KMT2ALMNA
SCHEMBL11337561 0.76 TP53 (0.56) DAOMEN1KMT2ALMNAL3MBTL1

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
EP-4663630-A1 NOVEL BENZIMIDAZOLONE DERIVATIVE COMPOUND AS AUTOTAXIN INHIBITOR LG Chem, Ltd. (KR) 2025-12-17 — — EP disclosed
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