SCHEMBL21043815

SCHEMBL21043815

CCCN1C(=O)CCc2cc(CNS(=O)(=O)c3cc(Cl)sc3Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.48
▸ TP53 P04637 4/20 0.43
▸ LMNA P02545 5/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ MAPT P10636 2/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ TMEM97 Q5BJF2 1/20 0.38

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
SCHEMBL21043854 0.92 POLB (0.50) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043774 0.86 POLB (0.63) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043849 0.83 MEN1 (0.49) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043801 0.82 POLB (0.45) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043794 0.81 BRD4 (0.53) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043781 0.81 POLB (0.46) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043847 0.81 POLB (0.44) POLBTP53LMNAHDAC1HDAC8
SCHEMBL19857236 0.81 MAPT (0.46) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043878 0.81 CYP19A1 (0.48) POLBTP53LMNAHDAC1HDAC8
SCHEMBL21043777 0.81 LMNA (0.50) POLBTP53LMNAHDAC1HDAC8

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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