SCHEMBL2554310

SCHEMBL2554310

O=C(O)N1C[C@@H]2C[C@H]1CN2C1CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.31

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
SCHEMBL6134967 0.90 HSD11B1 (0.40) HSD11B1
SCHEMBL5036242 0.84 ATM (0.32) HSD11B1
SCHEMBL23125323 0.82 CHRNB2 (0.32)
SCHEMBL71966 0.73 CHRM2 (0.49) HSD11B1
SCHEMBL610766 0.72 VNN1 (0.37) HSD11B1
SCHEMBL23404413 0.72 VNN1 (0.37) HSD11B1
SCHEMBL4335026 0.72 VNN1 (0.37) HSD11B1
SCHEMBL27006946 0.72 VNN1 (0.37) HSD11B1
SCHEMBL5501263 0.70 RAB9A (0.33)
SCHEMBL17057328 0.70 RAB9A (0.33)

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-2011121223-A1 6-(ALKYL- OR CYCLOALKYL-TRIAZOLOPYRIDAZINE-SULFANYL) BENZOTHIAZOLE DERIVATIVES: PREPARATION, APPLICATION AS MEDICAMENTS AND USE AS MET INHIBITORS SANOFI-AVENTIS (FR) 2011-10-06 WO disclosed