SCHEMBL8652139

SCHEMBL8652139

Nc1cccc(/N=N/c2cccc(N)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.58
CASP1 P29466 1/20 0.58
RECQL P46063 1/20 0.58
NOS1 P29475 1/20 0.58
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
RAB9A P51151 2/20 0.50
KMT2A Q03164 2/20 0.50
PKM P14618 1/20 0.50
HTT P42858 1/20 0.50
CA12 O43570 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
ALDH1A1 P00352 6/20 0.47
TDP1 Q9NUW8 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
CA1 P00915 1/20 0.46

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
SCHEMBL8128359 1.00 CYP3A4 (0.58) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL11322811 0.95 KMT2A (0.58) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL8773133 0.93 MEN1 (0.62) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL8773132 0.93 MEN1 (0.62) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL11332270 0.91 RAB9A (0.67) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL11332275 0.91 RAB9A (0.67) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL11322819 0.89 CYP3A4 (0.53) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL15087622 0.87 NOS1 (0.52) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL27297479 0.87 MEN1 (0.55) CYP3A4CASP1RECQLNOS1MEN1
SCHEMBL9066120 0.85 NOS1 (0.50) CYP3A4CASP1RECQLNOS1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5721324-A ADDITION POLYMERIZATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-02-24 US claimed
US-9932495-B2 Lignin derived photo-responsive coatings EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2018-04-03 US disclosed
US-20150307746-A1 LIGNIN DERIVED PHOTO-RESPONSIVE COATINGS CRESTLINE DIRECT FINANCE, L.P. 2015-10-29 US disclosed
US-8729307-B2 Photoresponsive ionic organic compound, method of producing the same, and photoresponsive carbon nanotube dispersant comprising said ionic organic compound NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2014-05-20 US disclosed
US-8729307-B2 Photoresponsive ionic organic compound, method of producing the same, and photoresponsive carbon nanotube dispersant comprising said ionic organic compound NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2014-05-20 US disclosed
US-20120217151-A1 PHOTORESPONSIVE IONIC ORGANIC COMPOUND, METHOD OF PRODUCING THE SAME, AND PHOTORESPONSIVE CARBON NANOTUBE DISPERSANT COMPRISING SAID IONIC ORGANIC COMPOUND NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-08-30 US disclosed
US-20120217151-A1 PHOTORESPONSIVE IONIC ORGANIC COMPOUND, METHOD OF PRODUCING THE SAME, AND PHOTORESPONSIVE CARBON NANOTUBE DISPERSANT COMPRISING SAID IONIC ORGANIC COMPOUND NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-08-30 US disclosed
US-5721324-A ADDITION POLYMERIZATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-02-24 US disclosed
US-5089628-A Heat resistance, moisture resistance, low dielectric constants CENTRAL GLASS COMPANY, LIMITED (JP) 1992-02-18 US disclosed
EP-0032745-B1 ETHER IMIDES AND PROCESS FOR PRODUCING THE SAME Hitachi, Ltd. (JP) 1987-01-07 EP disclosed
US-4592957-A Emulsifying a mixture of hydrophobic core and water polyamine; adding water soluble polyisocyanate bisulfite adduct BAYER AKTIENGESELLSCHAFT (DE) 1986-06-03 US disclosed
US-4517141-A POLYUREAS FROM BISULFITE- MASKED POLYISOCYANATES; PROTECTIVE COLLOIDS BAYER AKTIENGESELLSCHAFT (DE) 1985-05-14 US disclosed
US-4460783-A AMIDATION, CYCLIZATION, DEHYDRATION HITACHI, LTD. (JP) 1984-07-17 US disclosed
EP-0032745-A2 Ether imides and process for producing the same Hitachi, Ltd. (JP) 1981-07-29 EP disclosed
US-4271288-A TETRACARBOXYLIC ACID BONDED TO ARYLENE MOIETY VIA METHYLENE GROUPS THE DOW CHEMICAL COMPANY (US) 1981-06-02 US disclosed
US-4269966-A A MIXTURE OF AN ACRYLIC COMPOUND CONTAINING IMIDE, AMIDE, AND AN AMINE GROUP; MOLDING MATERIAL; CROSSLINKED, INSOLUBLE, INFUSIBLE POLYMER TECHNOCHEMIE GMBH VERFAHRENSTECHNIK (DE) 1981-05-26 US disclosed
US-4239883-A INFUSIBLE AND INSOLUBLE TECHNOCHEMIE GMBH VERFAHRENSTECHNIK (DE) 1980-12-16 US disclosed
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-3966900-A INSECTICIDES AIRWICK INDUSTRIES, INC. (US) 1976-06-29 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-20120217151-A1 PHOTORESPONSIVE IONIC ORGANIC COMPOUND, METHOD OF PRODUCING THE SAME, AND PHOTORESPONSIVE CARBON NANOTUBE DISPERSANT COMPRISING SAID IONIC ORGANIC COMPOUND CNTN1, CRY2, CRY1 CYP3A4 2759/4885CASP1 993/4885RECQL 1441/4885

“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.