SCHEMBL3655055

SCHEMBL3655055

CCCCCCCCCO[C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@H]1COC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.46
TK1 P04183 3/20 0.46
TK2 O00142 9/20 0.45
TYMP P19971 1/20 0.41

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
SCHEMBL6409391 1.00 RNASE1 (0.46) RNASE1TK1TK2TYMP
SCHEMBL6409396 1.00 RNASE1 (0.46) RNASE1TK1TK2TYMP
SCHEMBL7266100 0.91 RNASE1 (0.49) RNASE1TK1TK2TYMP
SCHEMBL6830771 0.89 RNASE1 (0.51) RNASE1TK1TYMP
SCHEMBL6832157 0.88 RNASE1 (0.49) RNASE1TK1TK2
SCHEMBL6827418 0.88 RNASE1 (0.53) RNASE1TK1TK2
SCHEMBL6323173 0.88 RNASE1 (0.51) RNASE1TK1TK2TYMP
SCHEMBL9393197 0.87 TK1 (0.59) RNASE1TK1TYMP
SCHEMBL6831287 0.86 RNASE1 (0.47) RNASE1TK1TYMP
SCHEMBL23045153 0.86 RNASE1 (0.57) RNASE1TK1TK2TYMP

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-2010054032-A2 APPARATUS AND METHOD USING ROTARY FLOW DISTRIBUTION MECHANISMS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2010-05-14 WO disclosed