SCHEMBL1668940

SCHEMBL1668940

O=C(NCCO)c1ccccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
KDM4E B2RXH2 3/20 0.65
MAPT P10636 2/20 0.65
CASP1 P29466 1/20 0.65
CASP7 P55210 1/20 0.65
HTT P42858 6/20 0.63
NPC1 O15118 2/20 0.63
HPGD P15428 2/20 0.63
HSD17B10 Q99714 2/20 0.63
TSHR P16473 2/20 0.63
NAAA Q02083 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
NLRP1 Q9C000 1/20 0.63
GAA P10253 2/20 0.57
MPO P05164 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HIF1A Q16665 1/20 0.57
ALOX5 P09917 1/20 0.56
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55

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
SCHEMBL31119120 0.90 HTT (0.69) ALDH1A1KDM4EMAPTHTTNPC1
SCHEMBL5707054 0.90 HTT (0.69) ALDH1A1KDM4EMAPTHTTNPC1
SCHEMBL31119121 0.90 HTT (0.69) ALDH1A1KDM4EMAPTHTTNPC1
SCHEMBL8980556 0.89 HTT (0.69) ALDH1A1KDM4EMAPTCASP1CASP7
SCHEMBL8346286 0.88 HTT (0.67) ALDH1A1KDM4EMAPTHTTNPC1
Hydrochloric Acid SCHEMBL15769882 0.88 HTT (0.67) ALDH1A1KDM4EMAPTHTTNPC1
SCHEMBL8894839 0.88 ALDH1A1 (0.62) ALDH1A1KDM4EMAPTCASP1CASP7
SCHEMBL3923471 0.87 ALOX5 (0.74) ALDH1A1KDM4EMAPTCASP1CASP7
SCHEMBL823552 0.85 NAAA (0.84) ALDH1A1KDM4EMAPTHTTNPC1
Hydrochloric Acid SCHEMBL15769552 0.85 HTT (0.73) ALDH1A1KDM4EMAPTHTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP claimed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO claimed
US-6995203-B2 Flame retardant polymer compositions THE BOEING COMPANY (US) 2006-02-07 US claimed
WO-2005071004-A2 FLAME RETARDANT POYLMER COMPOSITIONS THE BOEING COMPANY (US) 2005-08-04 WO claimed
US-20050049338-A1 Flame retardant polymer compositions BOEING COMPANY, THE 2005-03-03 US claimed
US-6261687-B1 BLEND CONTAINING CHELATED METAL OXIDE RELIANCE ELECTRIC TECHNOLOGIES, LLC 2001-07-17 US claimed
US-6224979-B1 INSULATING RESIN WITH CORONA RESISTANCE IN ELECTRICAL MOTORS, POLYMERIZATION MATERIAL AND A POLYCONDENSATION PRODUCT OF A PARTIALLY HYDROLYZED CHELATED METAL OXIDE PRECURSOR. RELIANCE ELECTRIC TECHNOLOGIES, LLC 2001-05-01 US claimed
US-6169119-B1 METAL OXIDE PRECURSOR AND MULTIFUNCTIONAL COMPOUND TO PROVIDE A CHELATED METAL OXIDE PRECURSOR, LOW VISCOSITY MATERIALS AND WHICH CAN LEAD TO THE CREATION OF TRANSPARENT RESINS SUSCEPTIBLE TO PHOTOCURING PROCESSES, FILLERS, INCORPORATED RELIANCE ELECTRIC TECHNOLOGIES, LLC 2001-01-02 US claimed
US-5962608-A LIQUID PHASE; HYDROLYSIS OF AN ORGANOMETALLIC COMPOUND RELIANCE ELECTRIC INDUSTRIAL CO. (US) 1999-10-05 US claimed
US-5709737-A AQUEOUS LIQUID VEHICLE, COLORANT, ALCOHOL ADDITIVE; SUITABLE FOR MICROWAVE DRYING PROCESSES XEROX CORPORATION (US) 1998-01-20 US claimed
JP-6025194-A None JP disclosed
US-10000591-B2 Catalyst system for polymerization of an olefin SAUDI BASIC INDUSTRIES CORPORATION (SA) 2018-06-19 US disclosed
US-9771345-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2017-09-26 US disclosed
US-20160311950-A1 CATALYST SYSTEM FOR POLYMERIZATION OF AN OLEFIN SAUDI BASIC INDUSTRIES CORPORATION (BA) 2016-10-27 US disclosed
US-20140161729-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2014-06-12 US disclosed
US-5153107-A 2-equivalent yellow and pyrazoloazole magenta couplers FUJI PHOTO FILM CO., LTD. (JP) 1992-10-06 US disclosed
EP-0497266-A1 Silver halide color reversal image forming method FUJI PHOTO FILM CO., LTD. (JP) 1992-08-05 EP disclosed
EP-0472153-A1 A silver halide color photographic material Fuji Photo Film Co., Ltd. (JP) 1992-02-26 EP disclosed
EP-0459458-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-12-04 EP disclosed
EP-0427225-A1 Direct positive color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-05-15 EP 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-20140161729-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM TNFSF11, CD14, TNFRSF1A ALDH1A1 2750/4885KDM4E 4722/4885MAPT 418/4885

“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.