SCHEMBL30848233

SCHEMBL30848233

Cc1nc2cc(-c3cc(C(=O)N(C)C)ccc3O)ccc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.42
ESR2 Q92731 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TLR8 Q9NR97 2/20 0.42
TLR7 Q9NYK1 2/20 0.42
LRRK2 Q5S007 1/20 0.40
ERN1 O75460 4/20 0.40
POLB P06746 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
DHODH Q02127 1/20 0.38
CDK1 P06493 1/20 0.37
CDK2 P24941 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
ADRB2 P07550 1/20 0.37
BRD4 O60885 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
SCHEMBL30798804 0.86 TDP1 (0.58) HSP90AA1ESR2TDP1POLBRAB9A
SCHEMBL29171880 0.86 TDP1 (0.58) HSP90AA1ESR2TDP1POLBRAB9A
SCHEMBL29171929 0.85 CHEK2 (0.46) HSP90AA1ESR2TDP1POLBRAB9A
SCHEMBL30848087 0.85 CHEK2 (0.46) HSP90AA1ESR2TDP1POLBRAB9A
SCHEMBL30798987 0.85 TLR8 (0.42) HSP90AA1ESR2TDP1TLR8TLR7
SCHEMBL8264538 0.85 HSP90AA1 (0.53) HSP90AA1ESR2TDP1TLR8TLR7
SCHEMBL30798800 0.84 TLR8 (0.43) HSP90AA1ESR2TDP1TLR8TLR7
SCHEMBL30798862 0.84 TLR8 (0.39) HSP90AA1ESR2TDP1TLR8TLR7
SCHEMBL30799136 0.84 BRD4 (0.41) HSP90AA1ESR2TDP1TLR8TLR7
SCHEMBL29171942 0.81 HDAC6 (0.53) HSP90AA1ESR2TDP1TLR8TLR7

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
EP-4585588-A1 BENZIMIDAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Suzhou Pharmavan Co., Ltd. (CN) 2025-07-16 EP disclosed
CN-117720472-A Benzimidazole compound, and preparation method and application thereof 苏州沪云新药研发股份有限公司 2024-03-19 CN disclosed