SCHEMBL2106709

SCHEMBL2106709

O=C1[C]=[C]C(=O)c2cc3ccccc3cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TP53 P04637 2/20 0.42
HPGD P15428 2/20 0.42
CASP1 P29466 2/20 0.42
CASP7 P55210 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
MEN1 O00255 3/20 0.39

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
SCHEMBL354514 0.75 MEN1 (0.56) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL29364188 0.75 MEN1 (0.56) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL30130196 0.75 MEN1 (0.56) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL28763536 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL9042905 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL1979202 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL1811522 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL1154675 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL5917389 0.73 ALDH1A1 (0.67) GSTP1ALDH1A1TP53HPGDCASP1
SCHEMBL16144676 0.72 MEN1 (0.53) GSTP1ALDH1A1TP53HPGDCASP1

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0293651-B1 Dicyanovinyl-substituted furan derivatives, process for their preparation, and their use SUEDZUCKER AG (DE) 1994-02-02 EP claimed
EP-2132244-B1 METHOD FOR PRODUCING COLORLESS ISOCYANURATES OF DIISOCYANATES BASF SE (DE) 2018-08-22 EP disclosed
EP-2099838-B1 METHOD FOR PRODUCING POLYISOCYANATES BASF SE (DE) 2017-06-14 EP disclosed
EP-2344563-B1 METHOD FOR PRODUCING COLOURLESS POLYISOCYANATES BASF SE (DE) 2017-06-14 EP disclosed
US-8969614-B2 Method for producing colourless polyisocyanates BASF SE (DE) 2015-03-03 US disclosed
US-8445622-B2 Process for preparing polyisocyanates BASF SE (DE) 2013-05-21 US disclosed
US-8373004-B2 Method for producing colorless isocyanurates of diisocyanates BASF SE (DE) 2013-02-12 US disclosed
US-8163390-B2 Radiation-curable compounds BASF SE (DE) 2012-04-24 US disclosed
US-20110251423-A1 METHOD FOR PRODUCING COLOURLESS POLYISOCYANATES BASF SE (DE) 2011-10-13 US disclosed
EP-2139935-B1 WATER-EMULSIFIABLE POLYISOCYANATES BASF SE (DE) 2010-12-01 EP disclosed
WO-1992021724-A2 ORGANO(POLY)SILOXANE COMPOSITIONS WHICH CAN BE CROSS-LINKED TO FORM ELASTOMERS WITH SEPARATION OF ALCOHOLS WACKER-CHEMIE GMBH (DE) 1992-12-10 WO disclosed
EP-0272216-B1 COMPOSITIONS OF MATTER BASED ON TETRACHLOROISOINDOLINONE PIGMENTS CIBA-GEIGY AG (CH) 1992-08-19 EP disclosed
EP-0479727-A1 Process for producing bisisoindolinone pigments CIBA-GEIGY AG (CH) 1992-04-08 EP disclosed
US-5091538-A DICYANOVINYLSUBSTITUTED FURAN DERIVATIVES SUDDEUTSCHE ZUCKER-AKTIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4892899-A Novel compositions based on tetrachloroisoindolinone pigments CIBA-GEIGY CORPORATION (US) 1990-01-09 US disclosed
US-4865650-A FOR COLORING HIGH MOLECULAR WEIGHT COMPONENTS; PAINTS; RHEOLOGY, LUSTER CIBA-GEIGY CORPORATION (US) 1989-09-12 US disclosed
EP-0321397-A2 Stuff compositions based on tetrachloroisoindolinone pigments CIBA-GEIGY AG (CH) 1989-06-21 EP disclosed
EP-0293651-A2 Dicyanovinyl-substituted furan derivatives, process for their preparation, and their use SÜDZUCKER AKTIENGESELLSCHAFT MANNHEIM/OCHSENFURT (DE) 1988-12-07 EP disclosed
EP-0272216-A2 Compositions of matter based on tetrachloroisoindolinone pigments CIBA-GEIGY AG (CH) 1988-06-22 EP disclosed
US-4165319-A Isoindoline pigments CIBA-GEIGY CORPORATION (US) 1979-08-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110251423-A1 METHOD FOR PRODUCING COLOURLESS POLYISOCYANATES TET3, HCCS, TET2 GSTP1 275/4885ALDH1A1 1813/4885TP53 2605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.