SCHEMBL23770574

SCHEMBL23770574

OC1CN(c2cccc(SNc3ccc(Cl)c(-c4cc(F)ccc4C(O)(O)O)n3)n2)C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.31
TYK2 P29597 1/20 0.31
MAP4K1 Q92918 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
SCHEMBL23770724 0.88 MAP4K1 (0.34) CCNT1TYK2MAP4K1
SCHEMBL23770741 0.88 ABL1 (0.35) CCNT1MAP4K1
SCHEMBL23770489 0.84 HSD11B1 (0.33) CCNT1MAP4K1
SCHEMBL23770850 0.80 LRRK2 (0.33)
SCHEMBL23770455 0.79 CCNT1 (0.32) CCNT1
SCHEMBL23770822 0.79 MPL (0.33) CCNT1TYK2
SCHEMBL23770669 0.74 HTR3A (0.40) CCNT1
SCHEMBL23770808 0.74 HTR3E (0.38) CCNT1
SCHEMBL23770836 0.74 MPL (0.33)
SCHEMBL23770753 0.73 GRIN2B (0.36)

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