SCHEMBL1900351

SCHEMBL1900351

O=C=Nc1ccc(CCCc2ccc(N=C=O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.68
TSHR P16473 1/20 0.68
P2RY6 Q15077 1/20 0.50
CYP1A2 P05177 1/20 0.49
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TRPA1 O75762 1/20 0.39
HTR2A P28223 1/20 0.35
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC1 Q13547 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
FFAR1 O14842 1/20 0.32
CALM1 P0DP23 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7898757 0.95 CYP3A4 (0.68) CYP3A4TSHRP2RY6CYP1A2MAPK1
SCHEMBL733010 0.91 CYP3A4 (0.74) CYP3A4TSHRP2RY6CYP1A2MAPK1
SCHEMBL10441239 0.89 CYP3A4 (0.55) CYP3A4TSHRP2RY6CYP1A2MAPK1
SCHEMBL22139933 0.88 TSHR (0.59) CYP3A4TSHRP2RY6CYP1A2MAPK1
SCHEMBL598023 0.88 CYP3A4 (0.59) CYP3A4TSHRP2RY6CYP1A2HTR2A
SCHEMBL1403683 0.86 CYP3A4 (0.57) CYP3A4TSHRHTR2ACYP2D6CYP2C9
SCHEMBL11764558 0.86 CYP3A4 (0.57) CYP3A4TSHRP2RY6CYP1A2MAPK1
SCHEMBL5885366 0.85 CYP3A4 (0.55) CYP3A4TSHRHTR2ACYP2D6CYP2C9
SCHEMBL10400983 0.85 CYP3A4 (0.55) CYP3A4TSHRHTR2ACYP2D6CYP2C9
SCHEMBL13725699 0.85 CYP3A4 (0.55) CYP3A4TSHRHTR2ACYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220306835-A1 METHOD FOR PREPARING POLYISOCYANATE COMPOSITION Hanwha Solutions Corporation (KR) 2022-09-29 US claimed
EP-4019564-A1 METHOD FOR PRODUCING POLYISOCYANATE COMPOSITION Hanwha Solutions Corporation (KR) 2022-06-29 EP claimed
US-4342861-A AN UNSATURATGED IMIDE AND A DI OR POLYISOCYANATE GO TO MAKE UP A POLYIMIDE POLYMER WHICH ALSO CONTAINS REPEATING AMIDE GROUPS RHONE-POULENC INDUSTRIES (FR) 1982-08-03 US claimed
US-4342860-A AN UNSATUREATED IMIDE IS USED WITH A DI OR POLYISOCYANATE TO FORM A POLYIMIDE POLYMER RHONE-POULENC INDUSTRIES (FR) 1982-08-03 US claimed
US-4302572-A MOLDING MATERIALS; COATINGS; HEAT RESISTANCE; THIN FILMS RHONE-POULENC INDUSTRIES (FR) 1981-11-24 US claimed
US-12565572-B2 Method for preparing polyisocyanate composition Hanwha Solutions Corporation (KR) 2026-03-03 US disclosed
EP-3943657-B1 TREATMENT AGENT FOR CORE WIRES FOR TRANSMISSION BELTS, AND CORE WIRE AND METHOD FOR PRODUCING SAME MITSUBOSHI BELTING LTD (JP) 2026-01-21 EP disclosed
US-12441091-B2 Friction transmission belt and manufacturing method thereof MITSUBOSHI BELTING LTD. (JP) 2025-10-14 US disclosed
EP-4036439-B1 FRICTION TRANSMISSION BELT MITSUBOSHI BELTING LTD (JP) 2025-02-26 EP disclosed
US-12180136-B2 Organic amine collection method ASAHI KASEL KABUSHIKI KAISHA (JP) 2024-12-31 US disclosed
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-12-26 US disclosed
EP-3739237-B1 FRICTION TRANSMISSION BELT AND MANUFACTURING METHOD THEREOF MITSUBOSHI BELTING LTD (JP) 2024-10-02 EP disclosed
US-5280062-A Polyesterurethane copolymer BAYER AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
US-5134188-A AQUEOUS SOLUTIONS OR DISPERSIONS OF HYDROXY-FUNCTIONAL COPOLYMERS AND A PROCESS FOR THEIR PRODUCTION BAYER AKTIENGESELLSCHAFT (DE) 1992-07-28 US disclosed
US-5126393-A Chip resistant polyesterurethanes; water-base paints for motor vehicles BAYER AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed
US-4981921-A LACTONE MODIFIED ACRYLATE BAYER AKTIENGESELLSCHAFT (DE) 1991-01-01 US disclosed
US-4980412-A WATERBASE PAINTS CONTAINING POLYANHYDRIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-12-25 US disclosed
US-4187365-A FROM POLYISOCYANATE, FORMIC ACID, AND DICARBOXYLIC ANHYDRIDE CONTAINING ANOTHER ACID GROUP BAYER AKTIENGESELLSCHAFT (DE) 1980-02-05 US disclosed
US-4031035-A Polyurethane-amide resins based upon isocyanate terminated prepolymers of bis-(2-hydroxyethyl)terephthalate CELANESE CORPORATION (US) 1977-06-21 US disclosed
US-3969394-A Polyurethanes CELANESE CORPORATION (US) 1976-07-13 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 (3 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-12565572-B2 Method for preparing polyisocyanate composition TYR, TDO2, ALKBH3 CYP3A4 843/4885TSHR 4612/4885P2RY6 3947/4885
US-12180136-B2 Organic amine collection method H1-0, F12, C1S CYP3A4 831/4885TSHR 1695/4885P2RY6 4189/4885
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION IDH3A, CA7, C9 CYP3A4 182/4885TSHR 4594/4885P2RY6 3234/4885

“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.