SCHEMBL4458076

SCHEMBL4458076

CCP(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.42
LTA4H P09960 5/20 0.41
TSHR P16473 1/20 0.39
KCNA3 P22001 1/20 0.39
CHRNB2 P17787 2/20 0.38
CHRNB4 P30926 2/20 0.38
CHRNA3 P32297 2/20 0.38
CHRNA7 P36544 2/20 0.38
CHRNA4 P43681 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.36
LMNA P02545 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL6907936 0.87 LTA4H (0.41) CA4LTA4HTSHRKCNA3CHRNB2
SCHEMBL4456043 0.81 LTA4H (0.41) CA4LTA4HTSHRKCNA3CHRNB2
SCHEMBL1726379 0.80 CA4 (0.42) CA4LTA4HTSHRKCNA3CHRNB2
SCHEMBL8902684 0.79 LTA4H (0.43) CA4LTA4HTSHRKCNA3LMNA
SCHEMBL4451586 0.78 LTA4H (0.47) CA4LTA4HKCNA3LMNAHTR1B
Hydrochloric Acid SCHEMBL25265550 0.76 ACHE (0.42) TSHRL3MBTL1LMNAALDH1A1
SCHEMBL17198448 0.76 LTA4H (0.39) CA4LTA4HTSHRKCNA3CHRNB2
Bromide SCHEMBL25197194 0.76 ACHE (0.42) TSHRL3MBTL1LMNAALDH1A1
SCHEMBL29193843 0.76 ACHE (0.52) L3MBTL1LMNAALDH1A1
SCHEMBL4458129 0.75 ALDH1A1 (0.44) CA4LTA4HTSHRKCNA3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534388-A1 Tungsten-imido catalysts for ring-opening metathesis polymerization of cycloolefins HERCULES INCORPORATED (US) 1993-03-31 EP claimed
EP-0010565-B1 PROCESS FOR PREPARING N-TRITYLIMIDAZOLE COMPOUNDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-11-10 EP claimed
US-4242479-A CATALYST OF ALUMINUM TRIHALIDE, ORGANOSILOXANE COMPOUND OR ETHER, MAGNESIUM ALCOHOLATE, TITANIUM-HALOGEN AND ORGANOALUMINUM COMPOUNDS SHOWA YUKA KABUSHIKI KAISHA (JP) 1980-12-30 US claimed
US-4216333-A Process for preparing N-tritylimidazole compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-08-05 US claimed
EP-0010565-A1 Process for preparing N-tritylimidazole compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-05-14 EP claimed
US-4045417-A POLYMERIZATION IN PRESENCE OF A TERTIARY AMINE, A PHOSPHORUS COMPOUND, AND A METAL HALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-30 US claimed
US-20240002313-A1 [11C]-LABELED ACYCLIC RETINOID, CENTRAL NERVOUS SYSTEM ACTIVATOR, AND PRODUCTION METHODS FOR SAME NATIONAL CENTER FOR GERIATRICS AND GERONTOLOGY (JP) 2024-01-04 US disclosed
CN-117098749-A [11C] Labeled acyclic retinoids, central nervous system activators and methods for their manufacture 国立研究开发法人国立长寿医疗研究中心 2023-11-21 CN disclosed
US-20230365726-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2023-11-16 US disclosed
EP-4249058-A1 [11C]-LABELLED ACYCLIC RETINOID, CENTRAL NERVOUS SYSTEM ACTIVATOR, AND PRODUCTION METHODS FOR SAME National Center for Geriatrics and Gerontology (JP) 2023-09-27 EP disclosed
CN-111518145-B Cyano-bridged metal organic compound with intramolecular magnetic transformation and preparation method and application thereof 荆楚理工学院 2023-06-20 CN disclosed
EP-4192887-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2023-06-14 EP disclosed
WO-2022107865-A1 [11C]-LABELLED ACYCLIC RETINOID, CENTRAL NERVOUS SYSTEM ACTIVATOR, AND PRODUCTION METHODS FOR SAME 国立研究開発法人国立長寿医療研究センター 2022-05-27 WO disclosed
US-4180636-A MAGNESIUM HALIDE, TITANIUM COMPOUND ELECTRON DONOR COMPOUND, TRIALKYL ALUMINUM CATALYST SHOWA DENKO KABUSHIKI KAISHA (JP) 1979-12-25 US disclosed
US-4125540-A WITH ORGANO-PHOSPHORUS COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1978-11-14 US disclosed
US-4118374-A PHOSPHITE, TERTIARY AMINE, LITHIUM OR CALCIUM HALIDE IN N-METHYLPYRROLIDONE OR DIMETHYLACETAMIDE AS POLYCONDENSATION SOLVENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-10-03 US disclosed
US-4087411-A TRIOXANE, BORON FLUORIDE-TYPE CATALYST MITSUBISHI GAS CHEMICAL COMPANY, INC. (JA) 1978-05-02 US disclosed
US-4045417-A POLYMERIZATION IN PRESENCE OF A TERTIARY AMINE, A PHOSPHORUS COMPOUND, AND A METAL HALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-30 US disclosed
US-4028481-A ACTIVATED TITANIUM TRICHLORIDE AND AN ORGANOALUMINUM COMPOUND MITSUI TOATSU CHEMICALS, INCORPORATED (JA) 1977-06-07 US disclosed
US-3992456-A BY REACTING BUTADIENE WITH WATER IN THE PRESENCE OF A PALLADIUM CATALYST UNION CARBIDE CORPORATION (US) 1976-11-16 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 (1 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-20240002313-A1 [11C]-LABELED ACYCLIC RETINOID, CENTRAL NERVOUS SYSTEM ACTIVATOR, AND PRODUCTION METHODS FOR SAME NR2E3, FABP7, RARB CA4 2189/4885LTA4H 3621/4885TSHR 8/4885

“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.