SCHEMBL2117652

SCHEMBL2117652

C=C(CC)C(C)CCCO

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CA1 P00915 2/20 0.31
LMNA P02545 2/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL11388436 0.93 SMN1; SMN2 (0.36) ALDH1A1SMN1; SMN2CA1LMNAHSD17B10
SCHEMBL18508660 0.83 CA1 (0.41) ALDH1A1CA1
SCHEMBL13622892 0.81 CA1 (0.50) CA1LMNA
SCHEMBL21064497 0.81 CA1 (0.50) CA1LMNA
SCHEMBL467227 0.79 GABRR1 (0.33) CA1
SCHEMBL11388470 0.79 TSHR (0.33) CA1TSHR
SCHEMBL24467918 0.77 CPB2 (0.35) ALDH1A1CA1MEN1KMT2ATSHR
SCHEMBL11056750 0.77
SCHEMBL466796 0.75
SCHEMBL21028381 0.74 EPHX1 (0.38) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877857-B2 Polar group-containing copolymer, rubber composition and studless tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2014-11-04 US disclosed
EP-2404944-B1 POLAR GROUP-CONTAINING COPOLYMER, RUBBER COMPOSITION AND STUDLESS TIRE SUMITOMO RUBBER IND (JP) 2014-05-14 EP disclosed
US-20120095153-A1 POLAR GROUP-CONTAINING COPOLYMER, RUBBER COMPOSITION AND STUDLESS TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-04-19 US disclosed