SCHEMBL5853276

SCHEMBL5853276

C/C=C/CCCCCCN(C)C

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
TSHR P16473 1/20 0.55
DNM1 Q05193 3/20 0.46
EPHX2 P34913 4/20 0.37
SIGMAR1 Q99720 2/20 0.34
KDM4A O75164 8/20 0.34
KDM4C Q9H3R0 8/20 0.34
KDM5A P29375 1/20 0.34
KDM7A Q6ZMT4 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 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
SCHEMBL5853282 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5854495 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5854998 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5855004 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5854501 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5853566 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL5853560 1.00 ALDH1A1 (0.55) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL31028855 0.97 ALDH1A1 (0.50) ALDH1A1TSHRDNM1EPHX2SIGMAR1
SCHEMBL15833678 0.90
SCHEMBL12845080 0.90

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