SCHEMBL199862

SCHEMBL199862

O=C=NCc1cc(CN=C=O)cc(CN=C=O)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.32
MIF P14174 3/20 0.32
TRPA1 O75762 2/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL459297 0.90 PGK1 (0.40) CYP3A4
SCHEMBL15435871 0.88 MIF (0.41) MIF
SCHEMBL11162063 0.88 RXRA (0.33) CYP3A4ALDH1A1
SCHEMBL27545979 0.88 RXRA (0.33) CYP3A4ALDH1A1
SCHEMBL5465655 0.85 MIF (0.47) CYP3A4MIFTRPA1TSHRALDH1A1
SCHEMBL2732258 0.85 TSHR (0.38) CYP3A4TSHR
SCHEMBL26785 0.85 MIF (0.47) CYP3A4MIFTRPA1TSHRALDH1A1
SCHEMBL27705400 0.85 PGK1 (0.35) CYP3A4TSHRALDH1A1
SCHEMBL15435860 0.84 VCAM1 (0.32)
SCHEMBL22471928 0.83 MIF (0.46) CYP3A4MIFTRPA1TSHRALDH1A1

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 1373 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114206964-B Rapid preparation of polyaspartates containing low primary amines and use of these polyaspartates in slow reactive polyurea systems 科思创有限公司 2025-02-11 CN claimed
US-20140329924-A1 NEW POLYMERS DERIVED FROM RENEWABLY RESOURCED LYSINOL DU PONT (US) 2014-11-06 US claimed
US-20140275311-A1 NEW POLYMERS DERIVED FROM RENEWABLY RESOURCED LYSINOL E I DU PONT DE NEMOURS AND COMPANY (US) 2014-09-18 US claimed
US-4389519-A Composition for polyurethane adhesives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-06-21 US claimed
EP-0053359-A1 Method of bonding films with a polyurethane adhesive Takeda Chemical Industries, Ltd. (JP) 1982-06-09 EP claimed
JP-57092077-A None JP disclosed
JP-62149720-A None JP disclosed
JP-55167269-A None JP disclosed
US-12637574-B2 Coating composition KANSAI PAINT CO., LTD. (JP) 2026-05-26 US disclosed
US-12637582-B2 Composition for coating materials NIPPON PAINT AUTOMOTIVE COATINGS CO., LTD. (JP) 2026-05-26 US disclosed
CN-122094989-A Polymer, water repellent, fiber product and method for producing fiber product 2026-05-26 CN disclosed
WO-2026099281-A1 TWO-COMPONENT POLYURETHANE COMPOSITION HAVING IMPROVED ADHESION AND ADJUSTABLE POT LIFE SIKA TECHNOLOGY AG (CH) 2026-05-15 WO disclosed
EP-0019893-B1 NOVEL TRIAMINES AND METHOD FOR PRODUCTION THEREOF Takeda Chemical Industries, Ltd. (JP) 1983-05-11 EP disclosed
EP-0021067-B1 TRIISOCYANATES, A PROCESS FOR THEIR PRODUCTION, THEIR USE FOR THE PRODUCTION OF POLYURETHANES AND A COATING COMPOSITION COMPRISING THESE POLYURETHANES Takeda Chemical Industries, Ltd. (JP) 1983-01-26 EP disclosed
US-4338256-A Triisocyanates TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-07-06 US disclosed
EP-0053359-A1 Method of bonding films with a polyurethane adhesive Takeda Chemical Industries, Ltd. (JP) 1982-06-09 EP disclosed
JP-S5792077-A COMPOSITION FOR POLYURETHANE ADHESIVE TAKEDA CHEM IND LTD 1982-06-08 JP disclosed
EP-0021067-A1 Triisocyanates, a process for their production, their use for the production of polyurethanes and a coating composition comprising these polyurethanes Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
JP-S55167269-A NOVEL TRIISOCYANATE COMPOUND AND ITS PREPARATION TAKEDA CHEM IND LTD 1980-12-26 JP disclosed
EP-0019893-A1 Novel triamines and method for production thereof Takeda Chemical Industries, Ltd. (JP) 1980-12-10 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 (2 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-12637574-B2 Coating composition ITGB3, ATG13, C9 CYP3A4 3403/4885MIF 2908/4885TRPA1 1581/4885
US-12637582-B2 Composition for coating materials CARM1, CBLB, EPHA3 CYP3A4 2750/4885MIF 919/4885TRPA1 365/4885

“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.