SCHEMBL10568933

SCHEMBL10568933

COCC(Cl)C(=O)Nc1cc(Cl)ccc1CC(=O)C(=O)Nc1nccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 2/20 0.46
▸ FFAR2 O15552 8/20 0.44
▸ LMNA P02545 2/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ GCK P35557 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL10568923 0.82 KCNMA1 (0.48) KCNMA1FFAR2LMNAKMT2AMEN1
SCHEMBL10665909 0.73 KDM4E (0.49) FFAR2LMNAKMT2AMEN1KDM4E
SCHEMBL10568929 0.73 FFAR2 (0.51) KCNMA1FFAR2LMNAKMT2AMEN1
SCHEMBL5950450 0.69 KCNMA1 (0.58) KCNMA1FFAR2LMNAKMT2AMEN1
SCHEMBL28353263 0.68 LMNA (0.66) KCNMA1FFAR2LMNAKMT2AMEN1
SCHEMBL30765198 0.68 LMNA (0.66) KCNMA1FFAR2LMNAKMT2AMEN1
SCHEMBL9601530 0.67 ALDH1A1 (0.43) LMNAKMT2AMEN1GAAKDM4E
SCHEMBL10660829 0.65 HSPA5 (0.44) FFAR2KMT2AMEN1KDM4EALDH1A1
SCHEMBL29684405 0.63 IRAK4 (0.55) KCNMA1KMT2AMEN1KDM4EPOLB
SCHEMBL27891187 0.62 FFAR2 (0.62) FFAR2LMNAKMT2AMEN1GAA

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
US-4845105-A 4-OH-quinoline carboxylic acid amides having analgesic and anti-inflammatory activity ROUSSEL UCLAF (FR) 1989-07-04 — — US disclosed
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