SCHEMBL5852964

SCHEMBL5852964

CC=CCCC(CC)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
CCR5 P51681 1/20 0.38
TAAR1 Q96RJ0 2/20 0.35
CYP2D6 P10635 1/20 0.35
HRH1 P35367 3/20 0.33
HTR2A P28223 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
MIF P14174 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TRPA1 O75762 3/20 0.33
HKDC1 Q2TB90 1/20 0.33
CTSD P07339 1/20 0.32
CTSE P14091 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL5852961 1.00 LMNA (0.39) LMNACCR5TAAR1CYP2D6HRH1
SCHEMBL5853738 0.89 LMNA (0.37) LMNACCR5TAAR1CYP2D6HRH1
SCHEMBL5853744 0.89 LMNA (0.37) LMNACCR5TAAR1CYP2D6HRH1
SCHEMBL5852712 0.88 NR1I2 (0.38) LMNACCR5TAAR1CYP2D6HRH1
SCHEMBL5852706 0.88 NR1I2 (0.38) LMNACCR5TAAR1CYP2D6HRH1
SCHEMBL5853598 0.87 AOC3 (0.38) LMNACCR5CYP2D6HRH1HTR2A
SCHEMBL5853605 0.87 AOC3 (0.38) LMNACCR5CYP2D6HRH1HTR2A
SCHEMBL5854233 0.84 CYP1A2 (0.39) LMNACYP2D6SIGMAR1ALDH1A1CYP1A2
SCHEMBL5854238 0.84 CYP1A2 (0.39) LMNACYP2D6SIGMAR1ALDH1A1CYP1A2
SCHEMBL28171775 0.84 TRPA1 (0.38) LMNACYP2D6HRH1HTR2AALDH1A1

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