SCHEMBL11027812

SCHEMBL11027812

CC(=O)Nc1cc(Cl)c(N)cc1OC(C)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BRPF1 P55201 1/20 0.44
▸ RORC P51449 4/20 0.43
▸ GAA P10253 1/20 0.42
▸ CHEK1 O14757 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ MAPK8 P45983 1/20 0.37
▸ MAPK9 P45984 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
SCHEMBL11025453 0.82 GAA (0.58) GAACHEK1ALDH1A1
SCHEMBL8610558 0.78 CA1 (0.47) GAAALDH1A1CA1CA2CA9
SCHEMBL9137511 0.76 CA1 (0.50) GAAALDH1A1CA1CA2CA9
SCHEMBL11027814 0.76 ALDH1A1 (0.45) RORCGAACHEK1ALDH1A1
SCHEMBL6811137 0.73 POLB (0.49) GAAALDH1A1CA1CA2CA9
Butanedione SCHEMBL28088921 0.73 CA1 (0.47) GAAALDH1A1CA1CA2CA9
SCHEMBL6815913 0.73 CA1 (0.44) GAAALDH1A1CA1CA2CA9
SCHEMBL9581250 0.73 ALDH1A1 (0.45) GAAALDH1A1MAPK8MAPK9
SCHEMBL11069418 0.73 CA1 (0.50) GAAALDH1A1CA1CA2CA9
SCHEMBL11690785 0.73 NPC1 (0.53) GAAALDH1A1

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-0159291-A1 Ink composition for the ink-jet printing process CIBA-GEIGY AG (CH) 1985-10-23 — — EP disclosed
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