SCHEMBL19981708

SCHEMBL19981708

CC1=CC(Nc2cc(Cl)nn(COCC[Si](C)(C)C)c2=O)N(C)N1C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 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
SCHEMBL173652 0.75 ALDH1A1 (0.38) DGAT1
SCHEMBL25697451 0.75 NPC1 (0.35) DGAT1
SCHEMBL160484 0.71 DGAT1 (0.36) DGAT1
SCHEMBL168671 0.71 CCNA2 (0.38)
SCHEMBL25219333 0.69 DGAT1 (0.39) DGAT1
SCHEMBL1392686 0.68 ROCK2 (0.35)
SCHEMBL31381549 0.67 DGAT1 (0.33) DGAT1
SCHEMBL25408348 0.66 DGAT1 (0.34) DGAT1
SCHEMBL29109010 0.65 KDM4E (0.34) DGAT1
SCHEMBL31022044 0.64 DGAT1 (0.33) DGAT1

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-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed