SCHEMBL21043781

SCHEMBL21043781

CCCN1C(=O)CCc2cc(CNS(=O)(=O)c3ccccc3F)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ TP53 P04637 2/20 0.43
▸ LMNA P02545 3/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.41
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ CHRM2 P08172 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ CHRM5 P08912 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ NR3C2 P08235 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ PKM P14618 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
SCHEMBL21043832 0.92 POLB (0.48) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043796 0.89 POLB (0.45) POLBRXFP1LMNAHDAC1HDAC8
SCHEMBL21043801 0.89 POLB (0.45) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043824 0.89 MAPT (0.43) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043847 0.88 POLB (0.44) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043791 0.86 NPY5R (0.44) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043777 0.85 LMNA (0.50) POLBTP53LMNATMEM97HDAC1
SCHEMBL21043807 0.85 CHRM1 (0.40) POLBRXFP1LMNATMEM97HDAC1
SCHEMBL21043850 0.84 HDAC1 (0.40) POLBRXFP1TP53LMNATMEM97
SCHEMBL21043867 0.84 POLB (0.59) POLBTP53LMNAMAPT

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