SCHEMBL6526148

SCHEMBL6526148

CCCCCCC1[CH]CC(CCCCCC)[CH]C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
EPHX1 P07099 1/20 0.41
TSHR P16473 2/20 0.40
THRB P10828 1/20 0.40
DNM1 Q05193 3/20 0.38
ALOX5 P09917 1/20 0.35
GBA1 P04062 3/20 0.34
CYP1A2 P05177 2/20 0.34
SPHK1 Q9NYA1 3/20 0.33
SPHK2 Q9NRA0 2/20 0.33
GUSB P08236 1/20 0.33

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
SCHEMBL6518340 1.00 ALDH1A1 (0.44) ALDH1A1EPHX1TSHRTHRBDNM1
SCHEMBL6520235 1.00 ALDH1A1 (0.44) ALDH1A1EPHX1TSHRTHRBDNM1
SCHEMBL6516816 1.00 ALDH1A1 (0.44) ALDH1A1EPHX1TSHRTHRBDNM1
SCHEMBL6522086 0.97 ALDH1A1 (0.41) ALDH1A1EPHX1TSHRTHRBDNM1
SCHEMBL5698371 0.97 ALDH1A1 (0.46) ALDH1A1EPHX1TSHRTHRBDNM1
SCHEMBL5239334 0.97
SCHEMBL16554088 0.95
SCHEMBL5273312 0.95
SCHEMBL6527161 0.90 CYP1A2 (0.39) ALDH1A1EPHX1TSHRTHRBCYP1A2
SCHEMBL5030035 0.87

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-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 US disclosed