SCHEMBL5855779

SCHEMBL5855779

CC/C=C/CCCCCCCN(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TSHR P16473 1/20 0.52
DNM1 Q05193 3/20 0.50
F7 P08709 2/20 0.42
F3 P13726 2/20 0.42
MAPT P10636 2/20 0.42
CYP19A1 P11511 2/20 0.42
OXER1 Q8TDS5 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
FFAR1 O14842 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
PLA2G1B P04054 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
PPARG P37231 1/20 0.42

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
SCHEMBL5855781 1.00 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL4396623 1.00 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL5852685 1.00 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL5852935 1.00 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL5852680 1.00 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL10434947 0.94 ALDH1A1 (0.52) ALDH1A1TSHRDNM1F7F3
SCHEMBL13868143 0.90 ALDH1A1 (0.43) ALDH1A1TSHRDNM1F7F3
SCHEMBL221500 0.86 DNM1 (0.71) ALDH1A1TSHRDNM1F7F3
SCHEMBL1333273 0.86 DNM1 (0.71) ALDH1A1TSHRDNM1F7F3
SCHEMBL165446 0.86 DNM1 (0.71) ALDH1A1TSHRDNM1F7F3

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