SCHEMBL5852893

SCHEMBL5852893

CCC=CCCCCCCB(CCC)CCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
ALOX15 P16050 3/20 0.40
HSD17B10 Q99714 3/20 0.40
F7 P08709 2/20 0.40
F3 P13726 2/20 0.40
FAAH O00519 2/20 0.40
CYP19A1 P11511 2/20 0.40
CYP3A4 P08684 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 2/20 0.40
RECQL P46063 2/20 0.40
BLM P54132 2/20 0.40
TRPV1 Q8NER1 1/20 0.40
OXER1 Q8TDS5 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
FFAR1 O14842 1/20 0.40
NR1I2 O75469 1/20 0.40
PLA2G1B P04054 1/20 0.40

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
SCHEMBL5852886 1.00 ALDH1A1 (0.40) ALDH1A1MAPTALOX15HSD17B10F7
SCHEMBL5854270 0.84 ALDH1A1 (0.41) ALDH1A1MAPTALOX15HSD17B10F7
SCHEMBL5854276 0.84 ALDH1A1 (0.41) ALDH1A1MAPTALOX15HSD17B10F7
SCHEMBL5852873 0.83 FAAH (0.35) MAPTALOX15HSD17B10F7F3
SCHEMBL5854728 0.83 FAAH (0.35) MAPTALOX15HSD17B10F7F3
SCHEMBL5852879 0.83 FAAH (0.35) MAPTALOX15HSD17B10F7F3
SCHEMBL5854734 0.83 FAAH (0.35) MAPTALOX15HSD17B10F7F3
SCHEMBL15458725 0.78 TRPV1 (0.55) ALDH1A1ALOX15HSD17B10F7F3
SCHEMBL3320012 0.78 ALDH1A1 (0.54) ALDH1A1MAPTALOX15HSD17B10F7
SCHEMBL5054346 0.78 ALDH1A1 (0.54) ALDH1A1MAPTALOX15HSD17B10F7

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