SCHEMBL129232

SCHEMBL129232

Cc1ccc(N=C=O)c(N=C=O)c1N=C=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.52
TRPA1 O75762 1/20 0.52
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 1/20 0.30

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
SCHEMBL28949324 0.94 CYP3A4 (0.47) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL295649 0.89 CYP3A4 (0.50) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL5577120 0.86 CYP3A4 (0.48) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL29930513 0.85 CYP3A4 (0.52) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL110656 0.85 CYP3A4 (0.52) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL291584 0.85 CYP3A4 (0.57) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL10316539 0.82 CYP3A4 (0.47) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL10316854 0.82 CYP3A4 (0.47) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL20145 0.81 CYP3A4 (0.63) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL30520271 0.81 CYP3A4 (0.63) CYP3A4TRPA1GABRA1GABRB2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598976-A1 A TWO-COMPONENT POLYURETHANE FOR POLYCARBONATE BONDING ARKEMA FRANCE (FR) 2025-08-13 EP claimed
CN-119998349-A Two-component polyurethane for polycarbonate bonding 阿科玛法国 2025-05-13 CN claimed
WO-2024074344-A1 A TWO-COMPONENT POLYURETHANE FOR POLYCARBONATE BONDING ARKEMA FRANCE (FR) 2024-04-11 WO claimed
EP-4349878-A1 A TWO-COMPONENT POLYURETHANE FOR POLYCARBONATE BONDING ARKEMA FRANCE (FR) 2024-04-10 EP claimed
US-20170361421-A1 HIGH REMOVAL RATE CHEMICAL MECHANICAL POLISHING PADS AND METHODS OF MAKING U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2017-12-21 US claimed
EP-2410971-B1 RADIATION-CURING, HIGHLY FUNCTIONAL POLYURETHANE (METH)ACRYLATE BASF SE (DE) 2017-08-16 EP claimed
US-9200108-B2 Radiation-curing, highly functional polyurethane (meth)acrylate BASF SE (DE) 2015-12-01 US claimed
CN-104169320-A Wood adhesive formulation HUNTSMAN INT LLC 2014-11-26 CN claimed
CN-104039855-A Wood Adhesive Formulation HUNTSMAN INT LLC 2014-09-10 CN claimed
CN-102015780-B Substrates and articles coated with aqueous 2K coating compositions PPG IND OHIO INC 2014-07-30 CN claimed
US-6416686-B2 Polyisocyanates BASF AKTIENGESELLSCHAFT (DE) 2002-07-09 US claimed
US-6376637-B1 USING BRANCHED POLYISOCYANATES BASF CORPORATION 2002-04-23 US claimed
US-20020007036-A1 High-functionality polyisocyanates BASF AKTIENGESELLSCHAFT (DE) 2002-01-17 US claimed
US-20010025096-A1 Polyisocyanates BASF AKTIENGESELLSCHAFT (DE) 2001-09-27 US claimed
EP-1134247-A2 Highfunctionality polyisocyanates BASF AKTIENGESELLSCHAFT (DE) 2001-09-19 EP claimed
EP-1134246-A2 Polyisocyanate BASF AKTIENGESELLSCHAFT (DE) 2001-09-19 EP claimed
EP-1026185-A1 Dendrimers and highly branched polyurethanes BASF AKTIENGESELLSCHAFT (DE) 2000-08-09 EP claimed
EP-0613913-A1 Crosslinking agent for polymer adhesives on the basis of reaction products of 2,4,6-triisocyanato-toluene and polyols BAYER AG (DE) 1994-09-07 EP claimed
EP-0072915-B1 PROCESS FOR PREPARING 2,4,6-TRIISOCYANATOTOLUENE BASF Aktiengesellschaft (DE) 1986-05-21 EP claimed
US-4456493-A ALKYNEDIOL AND FORMALDEHYDE PREPOLYMER WITH POLYISOCYANATE THIOKOL CORPORATION (US) 1984-06-26 US claimed

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-20020007036-A1 High-functionality polyisocyanates PCBP1, C9, CYP1B1 CYP3A4 72/4885TRPA1 2513/4885GABRA1 1146/4885

“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.