SCHEMBL21043832

SCHEMBL21043832

CCN1C(=O)CCc2cc(CNS(=O)(=O)c3ccccc3F)ccc21

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ ATAD2 Q6PL18 1/20 0.46
▸ TP53 P04637 2/20 0.44
▸ BRD4 O60885 1/20 0.43
▸ LMNA P02545 3/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ TMEM97 Q5BJF2 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ NR3C2 P08235 2/20 0.39
▸ MAPT P10636 1/20 0.39

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
SCHEMBL21043781 0.92 POLB (0.46) POLBRXFP1TP53BRD4LMNA
SCHEMBL21043848 0.89 POLB (0.46) POLBRXFP1ATAD2BRD4LMNA
SCHEMBL21043786 0.88 ATAD2 (0.47) POLBRXFP1ATAD2TP53LMNA
SCHEMBL21043826 0.88 ATAD2 (0.46) POLBRXFP1ATAD2TP53BRD4
SCHEMBL21043862 0.85 LMNA (0.52) POLBATAD2TP53LMNACYP1A2
SCHEMBL21043810 0.84 ATAD2 (0.46) POLBRXFP1ATAD2TP53BRD4
SCHEMBL21043837 0.83 ATAD2 (0.46) POLBRXFP1ATAD2TP53BRD4
SCHEMBL21043790 0.83 POLB (0.61) POLBATAD2TP53LMNAMAPT
SCHEMBL21043859 0.81 MAPT (0.48) POLBATAD2TP53LMNAMAPT
SCHEMBL21043880 0.81 ATAD2 (0.50) POLBATAD2TP53BRD4LMNA

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
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