SCHEMBL21043790

SCHEMBL21043790

CCN1C(=O)CCc2cc(CNS(=O)(=O)c3ccc(F)cc3)ccc21

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.61
▸ LMNA P02545 3/20 0.61
▸ USP2 O75604 1/20 0.50
▸ CYP19A1 P11511 1/20 0.50
▸ ATAD2 Q6PL18 1/20 0.48
▸ TP53 P04637 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA9 Q16790 1/20 0.46

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
SCHEMBL21043867 0.92 POLB (0.59) POLBLMNAUSP2CYP19A1TP53
SCHEMBL21043802 0.90 MAPT (0.53) POLBLMNACYP19A1ATAD2TP53
SCHEMBL21043825 0.89 CYP19A1 (0.54) POLBLMNACYP19A1ATAD2TP53
SCHEMBL21043884 0.89 CYP19A1 (0.50) POLBLMNACYP19A1ATAD2TP53
SCHEMBL21043862 0.89 LMNA (0.52) POLBLMNAATAD2TP53MAPT
SCHEMBL21043885 0.87 CYP19A1 (0.54) POLBLMNAUSP2CYP19A1ATAD2
SCHEMBL21043848 0.86 POLB (0.46) POLBLMNAATAD2MAPT
SCHEMBL21043832 0.83 POLB (0.48) POLBLMNAATAD2TP53MAPT
SCHEMBL21043831 0.83 ATAD2 (0.46) POLBLMNAATAD2TP53MAPT
SCHEMBL21043855 0.82 MAPT (0.52) POLBLMNACYP19A1TP53MAPT

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-3256447-B1 2-OXO-3,4-DIHYDROQUINOLINE COMPOUNDS AS PLANT GROWTH REGULATORS SYNGENTA PARTICIPATIONS AG (CH) 2019-06-05 — — EP disclosed
Send feedback