SCHEMBL21043786

SCHEMBL21043786

CCN1C(=O)CCc2cc(CNS(=O)(=O)c3ccccc3C)ccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATAD2 Q6PL18 1/20 0.47
▸ POLB P06746 4/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ TP53 P04637 3/20 0.45
▸ MAPT P10636 1/20 0.44
▸ LMNA P02545 4/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP11B1 P15538 1/20 0.43
▸ CYP11B2 P19099 1/20 0.43
▸ TMEM97 Q5BJF2 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 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
SCHEMBL21043801 0.92 POLB (0.45) ATAD2POLBRXFP1TP53MAPT
SCHEMBL21043859 0.88 MAPT (0.48) ATAD2POLBTP53MAPTLMNA
SCHEMBL21043832 0.88 POLB (0.48) ATAD2POLBRXFP1TP53MAPT
SCHEMBL21043826 0.88 ATAD2 (0.46) ATAD2POLBRXFP1TP53MAPT
SCHEMBL21043862 0.86 LMNA (0.52) ATAD2POLBTP53MAPTLMNA
SCHEMBL21043802 0.83 MAPT (0.53) ATAD2POLBTP53MAPTLMNA
SCHEMBL21043880 0.81 ATAD2 (0.50) ATAD2POLBTP53LMNACYP1A2
SCHEMBL21043848 0.81 POLB (0.46) ATAD2POLBRXFP1MAPTLMNA
SCHEMBL21043854 0.81 POLB (0.50) ATAD2POLBRXFP1TP53MAPT
SCHEMBL19865911 0.81 ATAD2 (0.54) ATAD2POLBTP53MAPTLMNA

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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