SCHEMBL722274

SCHEMBL722274

CC(C)c1cc(C(C)C)nc(C(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.44
NOS1 P29475 1/20 0.44
NOS2 P35228 1/20 0.44
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
CRHBP P24387 1/20 0.38
CYP2C19 P33261 1/20 0.38
CRHR2 Q13324 1/20 0.38
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
FABP3 P05413 2/20 0.34
FABP4 P15090 2/20 0.34
KDM5B Q9UGL1 1/20 0.34
HRH3 Q9Y5N1 3/20 0.33
FABP5 Q01469 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 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
SCHEMBL16414450 0.88 NOS3 (0.42) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL19007329 0.85 NOS3 (0.43) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL16477747 0.83 PTGS1 (0.39) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL18068020 0.83 NOS3 (0.38) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL25884519 0.81 NOS3 (0.40) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL18068052 0.79 ESR1 (0.36) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL21646563 0.79 SMN1; SMN2 (0.35) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL30147946 0.79 SMN1; SMN2 (0.35) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL4045335 0.78 NOS3 (0.34) NOS3NOS1NOS2CYP3A4CYP2D6
SCHEMBL4049194 0.78 NOS3 (0.34) NOS3NOS1NOS2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026090602-A1 PIGMENTED RESIN AND CATALYST COMPOSITIONS MATERIA, INC. (US) 2026-04-30 WO disclosed
EP-3110862-B1 ADHESION PROMOTER COMPOSITIONS FOR CYCLIC OLEFIN RESIN COMPOSITIONS ExxonMobil Product Solutions Company (US) 2026-04-01 EP disclosed
EP-4683900-A2 ROMP AND THERMAL INSULATION COMPOSITIONS AND MATERIALS AND USE THEREOF Materia, Inc. (US) 2026-01-28 EP disclosed
WO-2025245037-A1 CYCLIC OLEFIN COMPOSITIONS, ROMP COMPOSITIONS THEREOF, AND APPLICATIONS THEREOF MATERIA, INC. (US) 2025-11-27 WO disclosed
EP-4194092-B1 SYNTHESIS AND CHARACTERIZATION OF METATHESIS CATALYSTS UMICORE AG & CO KG (DE) 2025-10-22 EP disclosed
EP-2970522-B1 IN-MOLD COATING OF ROMP POLYMERS MATERIA INC (US) 2025-05-21 EP disclosed
US-20250122402-A1 LONG SHELF-LIFE STABLE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS CONTAINING PYRIDINE LIGATED PALLADIUM COMPOUNDS PROMERUS, LLC (US) 2025-04-17 US disclosed
EP-3013886-B1 THERMAL INSULATION MATERIA INC (US) 2025-03-26 EP disclosed
EP-2961778-B1 METAL CARBENE OLEFIN METATHESIS TWO CATALYST COMPOSITION MATERIA INC (US) 2025-02-26 EP disclosed
US-20250026871-A1 CYCLIC RUTHENIUM BENZYLIDENE INITIATORS FOR ENHANCED RING EXPANSION METATHESIS POLYMERIZATION UNIVERSITY OF WASHINGTON (US) 2025-01-23 US disclosed
US-6946533-B2 Synthesis of macrocyclic polymers by ring insertion polymerization of cyclic olefin monomers CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-09-20 US disclosed
EP-1543043-A2 SYNTHESIS OF MACROCYCLIC POLYMERS BY RING INSERTION POLYMERIZATION OF CYCLIC OLEFIN MONOMERS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-06-22 EP disclosed
EP-1497299-A2 CROSS-METATHESIS OF OLEFINS DIRECTLY SUBSTITUTED WITH AN ELECTRON-WITHDRAWING GROUP USING TRANSITION METAL CARBENE CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-01-19 EP disclosed
EP-0891970-B1 Process for producing alkenylsubstituted pyridine derivatives SUMITOMO CHEMICAL CO (JP) 2004-10-13 EP disclosed
US-20040132934-A1 Synthesis of macrocyclic polymers by ring insertion polymerization of cyclic olefin monomers CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-07-08 US disclosed
WO-2004013198-A2 SYNTHESIS OF MACROCYCLIC POLYMERS BY RING INSERTION POLYMERIZATION OF CYCLIC OLEFIN MONOMERS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2004-02-12 WO disclosed
US-20030236427-A1 Cross-metathesis of olefins directly substituted with an electron-withdrawing group using transition metal carbene catalysts NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-12-25 US disclosed
WO-2003087167-A2 CROSS-METATHESIS OF OLEFINS DIRECTLY SUBSTITUTED WITH AN ELECTRON-WITHDRAWING GROUP USING TRANSITION METAL CARBENE CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2003-10-23 WO disclosed
US-6008364-A Process for producing alkenyl--substituted pyridine derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-28 US disclosed
EP-0891970-A1 Process for producing alkenylsubstituted pyridine derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-01-20 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-20030236427-A1 Cross-metathesis of olefins directly substituted with an electron-withdrawing group using transition metal carbene catalysts OXER1, DUOX2, AOC2 NOS3 1321/4885NOS1 1132/4885NOS2 624/4885
US-20250026871-A1 CYCLIC RUTHENIUM BENZYLIDENE INITIATORS FOR ENHANCED RING EXPANSION METATHESIS POLYMERIZATION MCM7, MCM4, MCM5 NOS3 946/4885NOS1 985/4885NOS2 569/4885

“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.