SCHEMBL3295702

SCHEMBL3295702

C/C(N)=C/C(=O)OCCOC(=O)/C=C(/C)N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
ALDH1A1 P00352 5/20 0.39
TP53 P04637 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
HCAR2 Q8TDS4 4/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 2/20 0.35
CYP3A4 P08684 1/20 0.34
LMNA P02545 2/20 0.33
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL10480992 0.93 ALDH1A1 (0.45) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3198964 0.93 TSHR (0.50) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10373574 0.93 ALDH1A1 (0.45) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5755287 0.91 SMN1; SMN2 (0.38) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7657312 0.91 SMN1; SMN2 (0.38) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL26078304 0.91 SMN1; SMN2 (0.38) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL27956667 0.91 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL759827 0.91 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL7265941 0.89 TSHR (0.50) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL11006987 0.89 TSHR (0.50) TSHRALDH1A1ATMNPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741390-B2 Coordination-polymeric triethanolamineperchlorato(triflato)metal inner complexes as additives for synthetic polymers ARTEMIS RESEARCH GMBH & CO. KG (DE) 2010-06-22 US disclosed
US-20090131564-A1 COORDINATION-POLYMERIC TRIETHANOLAMINEPERCHLORATO(TRIFLATO)METAL INNER COMPLEXES AS ADDITIVES FOR SYNTHETIC POLYMERS IKA INNOVATIVE KUNSTSTOFFAUFBEREITUNG GMBH & CO. KG (DE) 2009-05-21 US disclosed
US-4424336-A Meat-curable mixture, which are stable on storage, of epoxide resin, 3-aminocrotonic acid derivatives and maleimide compound CIBA-GEIGY CORPORATION (US) 1984-01-03 US disclosed
US-4360655-A Heat-curable mixtures, which are stable on storage, of epoxide compounds β-aminocrotonic acid derivatives and polyamine CIBA-GEIGY CORPORATION (US) 1982-11-23 US disclosed
US-4348511-A POLYURETHANES MODIFIED WITH BETA-AMINOCROTONIC ACID DERIVATIVES CIBA-GEIGY CORPORATION (US) 1982-09-07 US disclosed
US-4291146-A Heat-curable mixtures, which are stable on storage, of expoxide resins and β-aminocrotonic acid derivatives CIBA-GEIGY CORPORATION (US) 1981-09-22 US disclosed
US-4284752-A Process for producing crosslinked unsaturated polymers by reaction of .beta. CIBA-GEIGY CORPORATION (US) 1981-08-18 US disclosed
US-4161580-A Thermosetting mixtures of polyimide beta-amino crotonic acid derivative and polyamine which are stable on storage CIBA-GEIGY CORPORATION (US) 1979-07-17 US disclosed
US-4089845-A Thermosetting mixtures which are stable on storage from polyimide and .beta. CIBA-GEIGY CORPORATION (US) 1978-05-16 US disclosed