SCHEMBL4889355

SCHEMBL4889355

CCC(C)CCC(O)(CC)CCCO

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 2/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TSHR P16473 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
SCHEMBL4883995 0.86 MEN1 (0.31) MEN1KMT2A
SCHEMBL26666745 0.81 MEN1 (0.34) MEN1KMT2A
SCHEMBL4892417 0.81 CYP4F2 (0.33) SMN1; SMN2LMNAALDH1A1HSD17B10CYP4F2
SCHEMBL4811939 0.80 ACE2 (0.30)
SCHEMBL4884697 0.77 MEN1 (0.30) MEN1KMT2A
SCHEMBL5873104 0.76 SMN1; SMN2 (0.45) SMN1; SMN2LMNAALDH1A1HSD17B10CYP4F2
SCHEMBL11855633 0.75 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL17560000 0.74 SMN1; SMN2 (0.52) SMN1; SMN2LMNAALDH1A1HSD17B10CYP4F2
SCHEMBL3645951 0.74 SMN1; SMN2 (0.46) SMN1; SMN2LMNAALDH1A1HSD17B10CYP4F2
SCHEMBL4889241 0.74 TSHR (0.35) TSHR

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
US-20080293880-A1 Liquid, Thermally Curable Mixtures, Their Preparation and Use BASF COATINGS AG (DE) 2008-11-27 US claimed