SCHEMBL104280

SCHEMBL104280

COc1ccccc1C#N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.66
GAA P10253 1/20 0.66
IMPDH2 P12268 1/20 0.59
IMPDH1 P20839 1/20 0.59
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
AR P10275 7/20 0.54
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
USP2 O75604 1/20 0.53
TSHR P16473 2/20 0.50
PGR P06401 2/20 0.50
PKM P14618 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL29518610 1.00 POLB (0.66) POLBGAAIMPDH2IMPDH1CA12
SCHEMBL28008968 0.98 POLB (0.63) POLBGAAIMPDH2IMPDH1CA12
Hydrochloric Acid SCHEMBL1144931 0.98 POLB (0.63) POLBGAAIMPDH2IMPDH1CA12
SCHEMBL19820790 0.98 POLB (0.63) POLBGAAIMPDH2IMPDH1CA12
Ammonia Solution, Strong SCHEMBL3942484 0.90 POLB (0.56) POLBGAAIMPDH2IMPDH1CA12
Benzonitrile SCHEMBL28124122 0.90 POLB (0.56) POLBGAAIMPDH2IMPDH1CA12
Anisole SCHEMBL28131523 0.90 POLB (0.71) POLBGAAIMPDH2IMPDH1CA12
Ethylene Glycol SCHEMBL28971846 0.90 GAA (0.56) POLBGAAIMPDH2IMPDH1CA12
SCHEMBL28994453 0.90 TSHR (0.69) POLBGAAIMPDH2IMPDH1CA12
Thianthrene SCHEMBL30427600 0.88 POLB (0.54) POLBGAAIMPDH2IMPDH1CA12

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 1358 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122051368-A Preparation method of gel electrolyte, quasi-solid lithium ion battery containing gel electrolyte and application of quasi-solid lithium ion battery 江苏国轩新能源科技有限公司 2026-05-15 CN claimed
US-20260002924-A1 METHOD FOR SELECTING ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS FROM MIXTURE OF ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS AND OTHER TYPES OF POLYMERS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2026-01-01 US claimed
US-12334500-B2 Rechargeable metal halide battery INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2025-06-17 US claimed
CN-119654312-A Substituted tetrazolyl compounds useful as T cell activators 百时美施贵宝公司 2025-03-18 CN claimed
EP-4477693-A1 METHOD FOR SELECTING ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS FROM MIXTURE OF ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS AND OTHER TYPES OF POLYMERS Korea Research Institute of Chemical Technology (KR) 2024-12-18 EP claimed
CN-119080623-A Application of catalyst in preparation of primary amine by catalyzing nitrile compound hydrogenation 嘉庚创新实验室 2024-12-06 CN claimed
US-20240400556-A1 AMIDOPYRIMIDONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-12-05 US claimed
US-20240360292-A1 EXTRACTANT AND EXTRACTION METHOD FOR REMOVING COLOR-EXPRESSING FOREIGN SUBSTANCES FROM COLORED POLYMER CONTAINING ESTER FUNCTIONAL GROUP, AND METHOD FOR CHEMICALLY SELECTING POLYMER CONTAINING ESTER FUNCTIONAL GROUP FROM COLORED POLYMER MIXTURE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2024-10-31 US claimed
EP-4255947-B1 METHOD FOR THE PRODUCTION OF THERMOPLASTIC POLYOXAZOLIDINONE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2024-07-03 EP claimed
CN-118257159-A Impregnated bond paper with good wear resistance and production process thereof 河北盛林装饰纸有限公司 2024-06-28 CN claimed
EP-0543128-B1 Diene polymers and copolymers terminated by reaction with aromatic nitriles BRIDGESTONE FIRESTONE INC (US) 1997-01-08 EP claimed
US-5475155-A Reacting an alpha-haloketone with a phenolic-hydroxyl containing compound and a strong protonic acid; neutralization; dehydrohalogenation; dealkylation THE DOW CHEMICAL COMPANY (US) 1995-12-12 US claimed
EP-0543305-B1 Diene polymers having reduced hysteresis and improved raw viscosity incorporating primary partial coupling and terminals formed from fused-ring polynuclear aromatic compounds or aromatic nitrile compounds BRIDGESTONE CORP (JP) 1995-10-11 EP claimed
WO-1995015301-A1 PREPARATION OF 4,4'-DIHYDROXY-ALPHA-ALKYLSTILBENES AND 4,4'-DIHYDROXY-ALPHA, ALPHA'-DIALKYLSTILBENES THE DOW CHEMICAL COMPANY (US) 1995-06-08 WO claimed
EP-0639587-A1 Diene polymeres and copolymers terminated with compounds having multiple-bonded nitrogen atoms and partially crosslinked with polyfunctional reagents BRIDGESTONE/FIRESTONE, INC. (US) 1995-02-22 EP claimed
US-5310798-A Tire treads BRIDGESTONE/FIRESTONE, INC. (US) 1994-05-10 US claimed
US-5254628-A Diene polymers having reduced hysteresis and improved raw viscosity incorporating primary partial coupling and terminals formed from aromatic nitrile compounds BRIDGESTONE CORPORATION (JP) 1993-10-19 US claimed
EP-0543128-A1 Diene polymers and copolymers terminated by reaction with aromatic nitriles BRIDGESTONE/FIRESTONE, INC. (US) 1993-05-26 EP claimed
EP-0543305-A1 Diene polymers having reduced hysteresis and improved raw viscosity incorporating primary partial coupling and terminals formed from fused-ring polynuclear aromatic compounds or aromatic nitrile compounds BRIDGESTONE CORPORATION (JP) 1993-05-26 EP claimed
US-5153271-A Conjugated homo- or copolyenes, aromatic olefin copolymers endcapped by benzonitrile(or derivataives), for reduced hystersis in tire treads BRIDGESTONE/FIRESTONE, INC. (US) 1992-10-06 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 (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-20260002924-A1 METHOD FOR SELECTING ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS FROM MIXTURE OF ESTER FUNCTIONAL GROUP-CONTAINING POLYMERS AND OTHER TYPES OF POLYMERS FGB, NR4A1, CYP2E1 POLB 1740/4885GAA 2757/4885IMPDH2 4251/4885
US-20240400556-A1 AMIDOPYRIMIDONE DERIVATIVES F12, XDH, CYP3A43 POLB 4154/4885GAA 2440/4885IMPDH2 683/4885

“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.