SCHEMBL27416239

SCHEMBL27416239

Cc1cc([SH](C)C)nc(C)n1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.33
APOBEC3G Q9HC16 1/20 0.33
GAA P10253 1/20 0.32
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
LMNA P02545 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
SCHEMBL196024 0.74
Water SCHEMBL6010194 0.72 POLB (0.50) POLBAPOBEC3GGAANOS3NOS1
SCHEMBL25926931 0.63 GRM4 (0.37) POLBLMNA
SCHEMBL786227 0.63
SCHEMBL508369 0.63
SCHEMBL6487423 0.63
SCHEMBL3083442 0.63
SCHEMBL28846028 0.63
SCHEMBL29411916 0.63
SCHEMBL958039 0.63

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
WO-2024138206-A1 FLUOROPYRIDOPYRIMIDINE AND FLUOROQUINAZOLINE DERIVATIES AND METHODS OF USE THEREOF FRONTIER MEDICINES CORPORATION (US) 2024-06-27 WO disclosed