SCHEMBL5854697

SCHEMBL5854697

CC=CCC(CCCC)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP1A2 P05177 3/20 0.35
CYP3A4 P08684 3/20 0.35
CYP2C9 P11712 3/20 0.35
TSHR P16473 3/20 0.35
CYP2C19 P33261 3/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
OPRL1 P41146 1/20 0.35
CYP2D6 P10635 2/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.34

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
SCHEMBL5854693 1.00 POLB (0.39) POLBALDH1A1KDM4ECYSLTR2CYSLTR1
SCHEMBL5853926 0.89 AOC3 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL5853924 0.89 AOC3 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL5854233 0.85 CYP1A2 (0.39) POLBALDH1A1KDM4ECYSLTR2CYSLTR1
SCHEMBL5854238 0.85 CYP1A2 (0.39) POLBALDH1A1KDM4ECYSLTR2CYSLTR1
SCHEMBL5853851 0.82 LMNA (0.42) CYP2D6LMNASMN1; SMN2HTR2A
SCHEMBL5853849 0.82 LMNA (0.42) CYP2D6LMNASMN1; SMN2HTR2A
SCHEMBL6682502 0.81 POLB (0.47) POLBALDH1A1KDM4ESIGMAR1OPRM1
SCHEMBL5202807 0.81 POLB (0.40) POLBALDH1A1KDM4ESIGMAR1OPRM1
SCHEMBL4994413 0.81 POLB (0.43) POLBALDH1A1KDM4ECYSLTR2CYSLTR1

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-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed