SCHEMBL10628293

SCHEMBL10628293

COC(=O)Nc1nc2cc(-c3ccccc3)ccc2n1S

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGPAT2 O15120 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ HDAC6 Q9UBN7 3/20 0.42
▸ TSHR P16473 2/20 0.41
▸ NR4A2 P43354 1/20 0.41
▸ HTT P42858 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ PIK3CG P48736 1/20 0.38
▸ LDHA P00338 1/20 0.37
▸ KCNMA1 Q12791 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL6393101 0.81 ALDH1A1 (0.41) AGPAT2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL14097365 0.76 HDAC6 (0.49) ALDH1A1KDM4EHSD17B10HDAC6HTT
SCHEMBL6393353 0.70 KDM4E (0.44) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL14097370 0.69 LMNA (0.59) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL11840974 0.68 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDHSD17B10PKM
SCHEMBL23610923 0.68 ALDH1A1 (0.52) ALDH1A1HPGDHDAC6TSHRHTT
SCHEMBL11177029 0.68 TSHR (0.64) ALDH1A1KDM4EHSD17B10PKMTSHR
SCHEMBL2092941 0.66 SMN1; SMN2 (0.68) ALDH1A1KDM4EHPGDHTTMEN1
SCHEMBL29145106 0.66 KDR (0.50) ALDH1A1KDM4EHPGDTSHRNR4A2
SCHEMBL2094875 0.66 MGLL (0.68) MEN1KMT2AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4792610-A Process for the preparation of 5-phenylsulfinyl-1H-2-(methoxycarbonylamino)-benzimidazole HOECHST AKTIENGESELLSCHAFT (DE) 1988-12-20 — — US claimed
US-4792610-A Process for the preparation of 5-phenylsulfinyl-1H-2-(methoxycarbonylamino)-benzimidazole HOECHST AKTIENGESELLSCHAFT (DE) 1988-12-20 — — US disclosed
US-4792610-A Process for the preparation of 5-phenylsulfinyl-1H-2-(methoxycarbonylamino)-benzimidazole HOECHST AKTIENGESELLSCHAFT (DE) 1988-12-20 — — US disclosed
US-3980796-A CONTROL OF PARASITES AND NEMATODES HOECHST AKTIENGESELLSCHAFT (DT) 1976-09-14 — — US disclosed
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