SCHEMBL27454590

SCHEMBL27454590

C=C(C)C(=O)OC.C=Cc1cccc(C=C)c1C=C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.50
▸ MAPT P10636 5/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ SLC9A1 P19634 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ TLR2 O60603 1/20 0.34
▸ ERN1 O75460 1/20 0.34
▸ TLR1 Q15399 1/20 0.34
▸ TLR6 Q9Y2C9 1/20 0.34
▸ ELANE P08246 1/20 0.34
▸ LMNA P02545 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ PLIN1 O60240 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
SCHEMBL2451012 0.89 ALDH1A1 (0.40) ALDH1A1MAPTNPSR1SLC9A1ADORA2A
SCHEMBL30075844 0.88 ALDH1A1 (0.56) ALDH1A1MAPTNPSR1ELANELMNA
SCHEMBL1483930 0.88 ALDH1A1 (0.56) ALDH1A1MAPTNPSR1ELANELMNA
SCHEMBL11232755 0.88 ALDH1A1 (0.56) ALDH1A1MAPTNPSR1ELANELMNA
SCHEMBL7568039 0.88 NFE2L2 (0.40) ALDH1A1MAPTLMNAKDM4ENFE2L2
SCHEMBL28108643 0.86 ALDH1A1 (0.40) ALDH1A1MAPTELANELMNAMEN1
Methacrylic Acid SCHEMBL27520585 0.83 ALDH1A1 (0.50) ALDH1A1MAPTNPSR1ELANELMNA
SCHEMBL28190407 0.83 ALDH1A1 (0.46) ALDH1A1MAPTNPSR1ELANELMNA
Methacrylic Acid SCHEMBL28827024 0.82 KDM4E (0.36) ALDH1A1MAPTSLC9A1ERN1LMNA
SCHEMBL5182045 0.82 ALDH1A1 (0.48) ALDH1A1MAPTNPSR1ELANELMNA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105255149-A Low-temperature toughened and reinforced PC/PBT (polycarbonate/polybenzothiazole) alloy material and preparation method thereof SHAANXI RES DESIGN INST PETROLEUM CHEMICAL INDUSTR 2016-01-20 — — CN claimed
CN-105255149-A Low-temperature toughened and reinforced PC/PBT (polycarbonate/polybenzothiazole) alloy material and preparation method thereof SHAANXI RES DESIGN INST PETROLEUM CHEMICAL INDUSTR 2016-01-20 — — CN disclosed
CN-101323699-B Preparation of PC/ABS alloy blend for automobile decoration piece CHINA NAT PETROLEUM CORP 2010-12-15 — — CN disclosed
CN-101463172-A Polychloroethylene mixture with excellent shock resistance and processability DONGRI ZHAO (CN) 2009-06-24 — — CN disclosed
CN-101463171-A Polychloroethylene mixture with excellent shock resistance and processability DONGRI ZHAO (CN) 2009-06-24 — — CN disclosed
CN-1827661-A Chlorinated polyethylene with high maximum elongation, and preparation process and application thereof ZHAO DONGRI (CN) 2006-09-06 — — CN disclosed
CN-1211164-C Medium milling RTP PHARMA INC (CA) 2005-07-20 — — CN disclosed
CN-1621442-A Modifier composition capable of improving shock resistance and processing performance of polyvinyl chloride SINOPEC CORP (CN) 2005-06-01 — — CN disclosed
CN-1441704-A Media milling RTP PHARMA INC (CA) 2003-09-10 — — CN disclosed
CN-1140457-A Styrene polymer and molded article IDEMITSU PETROCHEMICAL CO (JP) 1997-01-15 — — CN disclosed
CN-1129719-A Impact modified vinyl chloride resin composition, and graft copolymer compositions GEN ELECTRIC (US) 1996-08-28 — — CN disclosed
CN-1127762-A Process thermoplastic compositions and emulsion graft copolymer utilizing a polyacid GEN ELECTRIC (US) 1996-07-31 — — CN disclosed
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