SCHEMBL27354841

SCHEMBL27354841

Cc1nc(-c2cccc(Nc3ccc(I)cc3N)c2)cs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 5/20 0.52
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
MAPT P10636 5/20 0.47
LMNA P02545 3/20 0.46
PRMT6 Q96LA8 1/20 0.45
EGFR P00533 3/20 0.45
PTGES2 Q9H7Z7 1/20 0.41
BRD4 O60885 1/20 0.41
SYK P43405 1/20 0.40
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 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
SCHEMBL2644119 0.81 HTT (0.50) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL2645152 0.76 RET (0.45) ALDH1A1HPGDMAPTSYKMEN1
SCHEMBL27359055 0.74 RECQL (0.62) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL29833503 0.73 TSHR (0.54) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL2643153 0.73 CNR1 (0.40) ALDH1A1HPGDMAPTEGFRSYK
SCHEMBL219238 0.71 RECQL (1.00) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL8057745 0.70 MAPT (0.68) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL2624598 0.69 NPC1 (0.56) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL7298693 0.69 MAPT (0.59) RECQLTSHRHTTALDH1A1HPGD
SCHEMBL1764786 0.69 MAPT (0.70) HTTALDH1A1HPGDMAPTLMNA

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-1072669-C Benzimidazole compounds and their use as GABAAUse of receptor complex modulators NEURORES AS (DK) 2001-10-10 CN disclosed
CN-1182427-A Benzimidazole compounds and their use as modulators of GABA receptor complexes NEUROSEARCH AS (DK) 1998-05-20 CN disclosed