SCHEMBL6523743

SCHEMBL6523743

CCCCCCCC1[CH]CC[CH]C1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
EPHX1 P07099 1/20 0.35
GBA1 P04062 5/20 0.33
SPHK1 Q9NYA1 2/20 0.33
GUSB P08236 1/20 0.33
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
ALOX5 P09917 1/20 0.31
GLB1 P16278 1/20 0.30
GBA2 Q9HCG7 1/20 0.30
CYP1A2 P05177 2/20 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
SCHEMBL6523122 1.00 ALDH1A1 (0.38) ALDH1A1EPHX1GBA1SPHK1GUSB
SCHEMBL6525983 1.00 ALDH1A1 (0.38) ALDH1A1EPHX1GBA1SPHK1GUSB
SCHEMBL6520089 1.00 ALDH1A1 (0.38) ALDH1A1EPHX1GBA1SPHK1GUSB
SCHEMBL6525365 1.00 ALDH1A1 (0.38) ALDH1A1EPHX1GBA1SPHK1GUSB
SCHEMBL6527520 0.98 ALDH1A1 (0.34) ALDH1A1EPHX1GBA1SPHK1GUSB
SCHEMBL6518118 0.92 CYP1A2 (0.32) CYP1A2
SCHEMBL6518478 0.83
SCHEMBL5239334 0.83
SCHEMBL5698371 0.83 ALDH1A1 (0.46) ALDH1A1EPHX1GBA1SPHK1TSHR
SCHEMBL6518340 0.81 ALDH1A1 (0.44) ALDH1A1EPHX1GBA1SPHK1GUSB

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