SCHEMBL6730106

SCHEMBL6730106

Cc1c(F)c(=O)[nH]c(=O)n1COCC[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.33

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
SCHEMBL25344514 0.83 ALDH1A1 (0.39) ALDH1A1NPC1
SCHEMBL10479252 0.72 LMNA (0.44)
SCHEMBL6722438 0.72 ATM (0.38) ALDH1A1NPC1
SCHEMBL25344141 0.71 NPC1 (0.35) NPC1
SCHEMBL6719388 0.71 MAPT (0.45) NPC1
SCHEMBL30999963 0.71 PARP1 (0.32) NPC1
SCHEMBL6719104 0.71 NPC1 (0.53) ALDH1A1NPC1
SCHEMBL6723898 0.71 PNP (0.36) ALDH1A1NPC1
SCHEMBL6719796 0.71 DUT (0.37) ALDH1A1NPC1
SCHEMBL6723712 0.71 ADORA2B (0.37) ALDH1A1NPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6673804-B1 PREVENTING OR TREATING ARTHRITIS (PARTICULARLY OSTEOARTHRITIS) OR INHIBITING METASTASIS, INVASION OR GROWTH OF CANCER (PARTICULARLY BREAST CANCER) SANKYO COMPANY, LIMITED (JP) 2004-01-06 US disclosed
EP-1069110-A1 SULFONAMIDE DERIVATIVES Sankyo Company Limited (JP) 2001-01-17 EP disclosed