SCHEMBL426440

SCHEMBL426440

Fc1cnc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.57
PDGFRB P09619 3/20 0.50
PDGFRA P16234 3/20 0.50
MGAM O43451 1/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
ACHE P22303 1/20 0.48
CYP2A6 P11509 2/20 0.47
BIRC5 O15392 1/20 0.46
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
KDM4E B2RXH2 1/20 0.45
GPR3 P46089 1/20 0.45
EGFR P00533 1/20 0.45
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP11B1 P15538 1/20 0.43

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
SCHEMBL18805061 1.00 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL30821765 1.00 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
Phosphonic Acid SCHEMBL31552898 0.89 MGAM (0.50) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL3868339 0.79 BACE1 (0.47) CYP1A2PDGFRBPDGFRAMAPTCYP2A6
SCHEMBL30824470 0.78 ALDH1A1 (0.44) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL29378174 0.78 PDGFRB (0.66) CYP1A2PDGFRBPDGFRAMAPTCYP2A6
SCHEMBL2347880 0.78 PDGFRB (0.66) CYP1A2PDGFRBPDGFRAMAPTCYP2A6
SCHEMBL21508015 0.77 CLK2 (0.46) PDGFRBPDGFRACYP2A6BIRC5RAB9A
SCHEMBL32667946 0.76 PDGFRB (0.77) CYP1A2PDGFRBPDGFRAMGAMALDH1A1
SCHEMBL2772360 0.76 PDGFRB (0.77) CYP1A2PDGFRBPDGFRAMGAMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3644992-B1 3-(1H-PYRAZOL-4-YL)PYRIDINE ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR MERCK SHARP & DOHME LLC (US) 2023-03-29 EP claimed
CN-108107142-B Analysis method of surfactant in wax removal water 上海微谱化工技术服务有限公司 2020-05-22 CN claimed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US claimed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 US claimed
EP-1687276-B1 NOVEL METHOD OF PREPARING 3-FLUORINATED QUINOLINES NOVEXEL (FR) 2009-10-14 EP claimed
US-7396934-B2 Process for preparing 3-fluoroquinolines NOVEXEL (FR) 2008-07-08 US claimed
US-20050182259-A1 Subjecting a substituted quinoline-3-carboxamide compound to Hofmann degradation to obtain amine derivative, forming diazonium salt by reacting amine derivative with borontrifluoride-ethyl ether complex, heating to form 3-fluoroquinolines; intermediate for forming antibacterial compound AVENTIS PHARMA S.A. (US) 2005-08-18 US claimed
US-6903217-B2 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. (FR) 2005-06-07 US claimed
US-20260048151-A1 HEMICYANINE PUSH-PULL DYES BASED ON CHROMENE ELECTRON DONORS UNIV CONNECTICUT (US) 2026-02-19 US disclosed
CN-119775316-A Quinoline phosphonate derivative and synthetic method and application thereof 中苏圆科技集团有限公司 2025-04-08 CN disclosed
CN-119144124-A Composite material and preparation method thereof, film, photoelectric device and preparation method thereof, and display device TCL科技集团股份有限公司 2024-12-17 CN disclosed
WO-2024044214-A1 HEMICYANINE PUSH-PULL DYES BASED ON CHROMENE ELECTRON DONORS UNIVERSITY OF CONNECTICUT (US) 2024-02-29 WO disclosed
WO-2024044214-A1 HEMICYANINE PUSH-PULL DYES BASED ON CHROMENE ELECTRON DONORS UNIVERSITY OF CONNECTICUT (US) 2024-02-29 WO disclosed
EP-3183250-B1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL CLAP CO LTD (KR) 2023-10-04 EP disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0259687-A2 Method for the preparation of pyridine-2,3-dicarboxylic acids AMERICAN CYANAMID COMPANY (US) 1988-03-16 EP disclosed
EP-0257518-A1 Quinoline-8-carboxylic acid derivatives BASF Aktiengesellschaft (DE) 1988-03-02 EP disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
US-4135045-A PROCESS FOR POLYMERIZATION OF OLEFINS AND CATALYST COMPOSITION THEREFOR MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1979-01-16 US disclosed
US-4048415-A TITANIUM-ALUMINUM COORDINATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) 1977-09-13 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-20260048151-A1 HEMICYANINE PUSH-PULL DYES BASED ON CHROMENE ELECTRON DONORS MB, CRY2, S100A10 CYP1A2 1391/4885PDGFRB 1067/4885PDGFRA 795/4885
US-20050182259-A1 Subjecting a substituted quinoline-3-carboxamide compound to Hofmann degradation to obtain amine derivative, forming diazonium salt by reacting amine derivative with borontrifluoride-ethyl ether complex, heating to form 3-fluoroquinolines; intermediate for forming antibacterial compound QRFPR, NQO2, DHX35 CYP1A2 378/4885PDGFRB 3699/4885PDGFRA 2461/4885
US-10224485-B2 Process for preparing a crystalline organic semiconductor material STOM, SPOP, TTR CYP1A2 2553/4885PDGFRB 4797/4885PDGFRA 4488/4885

“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.