SCHEMBL970790

SCHEMBL970790

C1CC2CCC12.CC1(C(=O)O)CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CCR2 P41597 1/20 0.36
CYP2C19 P33261 2/20 0.35
MAPK1 P28482 2/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
THPO P40225 1/20 0.35
STAT6 P42226 1/20 0.35
HIF1A Q16665 1/20 0.35
NPC1 O15118 1/20 0.35
GMNN O75496 1/20 0.35
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL13075127 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL19322861 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL13075808 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL14627497 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL18449 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL25213839 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL60503 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL13341342 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL11922843 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19
SCHEMBL10268820 0.88 FFAR3 (0.72) FFAR3SMN1; SMN2ALDH1A1CCR2CYP2C19

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-20110008577-A1 PROCESS FOR PRODUCTION OF FINE STRUCTURE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2011-01-13 US disclosed
EP-2261007-A1 PROCESS FOR PRODUCTION OF NANOSTRUCTURES Daicel Chemical Industries, Ltd. (JP) 2010-12-15 EP disclosed