SCHEMBL13773347

SCHEMBL13773347

Cc1ccc(O)c(Cn2c(N)nc3c(C)cc(C(=O)O)cc32)n1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ AGTR1 P30556 14/20 0.35
▸ AGTR2 P50052 3/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34
▸ DCTPP1 Q9H773 1/20 0.33
▸ PPARG P37231 1/20 0.33

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
SCHEMBL8284689 0.87 CA12 (0.39) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284613 0.85 KDM4E (0.41) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284698 0.83 CDK1 (0.42) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284693 0.82 KDM4E (0.37) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284692 0.82 KDM4E (0.44) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284700 0.73 CA12 (0.45) KDM4EALDH1A1
SCHEMBL2536267 0.73 MAPT (0.41) KDM4EHPGDALDH1A1
SCHEMBL13932114 0.72 KDM4E (0.43) KDM4EHPGDUSP2HSD17B10ALDH1A1
SCHEMBL8284696 0.71 SIRT2 (0.48) KDM4EHPGDALDH1A1
SCHEMBL8284602 0.70 KDM4E (0.38) KDM4EHPGDUSP2HSD17B10ALDH1A1

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-1697343-B1 AMINOBENZIMIDAZOLES AND BENZIMIDAZOLES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS REPLICATION TIBOTEC PHARM LTD (IE) 2009-07-01 — — EP disclosed
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