SCHEMBL31069489

SCHEMBL31069489

[2H]c1ccnc(Nc2cccc(S(N)(=O)=O)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 2/20 0.53
SYK P43405 3/20 0.52
CDK1 P06493 8/20 0.50
CDK2 P24941 6/20 0.50
CCNT1 O60563 5/20 0.50
CCNB1 P14635 5/20 0.50
CDK9 P50750 5/20 0.50
CCNA2 P20248 3/20 0.50
CCNE1 P24864 2/20 0.50
CDK5 Q00535 2/20 0.50
CCND3 P30281 1/20 0.50
FLT3 P36888 1/20 0.50
CDK6 Q00534 1/20 0.50
CDK5R1 Q15078 1/20 0.50
CDK7 P50613 2/20 0.49
CCNH P51946 2/20 0.49
CCNA1 P78396 2/20 0.49
LYN P07948 2/20 0.49
TXK P42681 1/20 0.49
MTOR P42345 2/20 0.48

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
SCHEMBL30557958 0.91 ROCK1 (0.61) ROCK1SYKCDK1CDK2CCNT1
SCHEMBL27397516 0.80 ROCK1 (0.55) ROCK1SYKCDK1CDK2CCNT1
Benzenesulfonamide SCHEMBL4876630 0.77 IKBKB (0.61) CA9IKBKBAURKAGSK3BAURKB
SCHEMBL12325169 0.77 ROCK1 (0.62) ROCK1SYKCDK1CDK2CCNT1
SCHEMBL7464681 0.76 CDK1 (0.61) SYKCDK1CDK2CCNT1CCNB1
SCHEMBL30023485 0.75 FEN1 (0.44) ROCK1SYKCDK1CDK2CCNT1
SCHEMBL1652316 0.74 IKBKB (0.64) ROCK1CA9IKBKBAURKAGSK3B
SCHEMBL29484614 0.73 MAPT (0.52) CDK1CDK2CCNB1LYNIKBKB
SCHEMBL7524252 0.73 CDK1 (0.69) SYKCDK1CDK2CCNT1CCNB1
SCHEMBL30023065 0.72 SYK (0.49) SYKCDK1CDK2CCNT1CCNB1

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
US-20240252688-A1 COMPOSITIONS AND METHODS FOR ENHANCED PROTEIN PRODUCTION HDT BIO CORP. 2024-08-01 US disclosed