SCHEMBL23770754

SCHEMBL23770754

Cc1ccc(F)cc1-c1nc(NSc2cccc(N3CCC34CNC4)n2)ccc1Cl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.31
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30
EPHA4 P54764 1/20 0.30
GPR139 Q6DWJ6 1/20 0.30

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
SCHEMBL23770808 0.84 HTR3E (0.38) ABL1CCNT1CDK9
SCHEMBL19927782 0.82 ABL1 (0.32) ABL1GPR139
SCHEMBL23770855 0.80 ABL1 (0.32) ABL1
SCHEMBL23770741 0.79 ABL1 (0.35) ABL1CCNT1CDK9
SCHEMBL23770831 0.78 ABL1 (0.33) ABL1
SCHEMBL23770685 0.77 ABL1 (0.37) ABL1CCNT1EPHA4
SCHEMBL23770558 0.77 AGPAT2 (0.40) ABL1EPHA4
SCHEMBL23770508 0.76 ABL1 (0.35) ABL1
SCHEMBL23770446 0.75 SUV39H2 (0.39) CCNT1CDK9
SCHEMBL23770669 0.74 HTR3A (0.40) CCNT1CDK9

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-3504194-B1 N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-08-18 EP disclosed