SCHEMBL2640943

SCHEMBL2640943

CC1(C)OB(c2cn[nH]c2)OC1(C)C.CC1(C)OB(c2cnn(CCO)c2)OC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.52
PDK2 Q15119 2/20 0.30
DGAT1 O75907 1/20 0.30
KIT P10721 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
SCHEMBL20759 0.88 FFAR1 (0.64) FFAR1PDK2DGAT1KIT
SCHEMBL29582665 0.80 FFAR1 (0.61) FFAR1DGAT1
SCHEMBL1854359 0.80 FFAR1 (0.61) FFAR1PDK2DGAT1
SCHEMBL98961 0.79 LPL (0.40) FFAR1DGAT1
SCHEMBL6104470 0.79 FFAR1 (0.45) FFAR1
SCHEMBL9281960 0.79 FFAR1 (0.59) FFAR1PDK2DGAT1
Boric Acid SCHEMBL25234240 0.79 FFAR1 (0.64) FFAR1PDK2DGAT1KIT
SCHEMBL27031982 0.78 FFAR1 (0.56) FFAR1DGAT1
Hydrochloric Acid SCHEMBL15656117 0.78 LPL (0.39) FFAR1DGAT1
SCHEMBL25297920 0.78 FFAR1 (0.58) FFAR1PDK2DGAT1

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
EP-2569301-A1 INDAZOLE INHIBITORS OF KINASE Abbvie Inc. (US) 2013-03-20 EP disclosed
WO-2011143430-A1 INDAZOLE INHIBITORS OF KINASE ABBOTT LABORATORIES (US) 2011-11-17 WO disclosed