SCHEMBL458385

SCHEMBL458385

O=C1c2cc(Cl)c(Cl)c(Cl)c2C(=O)N1Cl

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
ALDH1A1 P00352 1/20 0.33
AHR P35869 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
CA7 P43166 1/20 0.30

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
Ethylene SCHEMBL16860553 0.96 CYP3A4 (0.32) CYP3A4ALDH1A1AHRCA1CA2
SCHEMBL9703822 0.82 CYP3A4 (0.31) CYP3A4ALDH1A1
SCHEMBL9485161 0.78 ALDH1A1 (0.40) CYP3A4ALDH1A1GRIN2DGRIN3BGRIN1
SCHEMBL3684155 0.75 CES1 (0.37) ALDH1A1AHR
SCHEMBL6846394 0.73 CYP3A4 (0.30) CYP3A4
SCHEMBL7276600 0.71 UCHL1 (0.41) ALDH1A1CA1CA2CA12CA9
SCHEMBL9438330 0.68 CA1 (0.57) CA1CA2CA12CA9CA7
SCHEMBL454552 0.67 KDM4E (0.41) ALDH1A1
SCHEMBL9360881 0.67 CYP3A4 (0.35) CYP3A4ALDH1A1AHR
SCHEMBL438003 0.64 CYP3A4 (0.56) CYP3A4ALDH1A1AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12365678-B2 Pharmaceutical process for the preparation of 4-{4-[(3R)-3-methylmorpholin-4-yl]-6-[1-((R)-S-methylsulfonimidoyl) cyclopropyl]pyrimidin-2-yl}-1H-pyrrolo[2,3-b] pyridine and intermediates ASTRAZENECA AB (SE) 2025-07-22 US claimed
CN-119534412-A Method for rapidly detecting out-of-standard methanol in gasoline on site 福建师范大学 2025-02-28 CN claimed
US-20250002522-A1 OLIGOSACCHARIDE COMPOUNDS AND COMPLEXES CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (ES) 2025-01-02 US claimed
CN-118414345-A Oligosaccharide compounds and complexes 生物技术公司 2024-07-30 CN claimed
EP-4402150-A1 OLIGOSACCHARIDE COMPOUNDS AND COMPLEXES BioNTech SE (DE) 2024-07-24 EP claimed
CN-113195728-B Pharmaceutical process and intermediates 阿斯利康(瑞典)有限公司 2024-07-16 CN claimed
EP-4286394-A1 OLIGOSACCHARIDE COMPOUNDS AND COMPLEXES BioNTech SE (DE) 2023-12-06 EP claimed
CN-115417849-B Method for catalytic synthesis of 3-isochromone 河南省化工研究所有限责任公司 2023-09-26 CN claimed
CN-116640066-A Method for synthesizing alkyl unnatural amino acid derivative by photocatalysis 大连理工大学 2023-08-25 CN claimed
CN-116601163-A Protected disaccharides, methods for their preparation, their use in the synthesis of zwitterionic oligosaccharides and conjugates thereof 巴斯德研究所 2023-08-15 CN claimed
US-6187931-B1 Process for making fluorophthalimides ALBEMARLE CORPORATION 2001-02-13 US claimed
EP-0558974-B1 Process for manufacturing unsaturated fatty acids K D PHARMA GMBH (DE) 1996-01-31 EP claimed
US-5362895-A Method of recovering unsaturated fatty acids K.D. PHARMA GMBH (DE) 1994-11-08 US claimed
EP-0558974-A1 Process for manufacturing unsaturated fatty acids K.D. PHARMA GmbH (DE) 1993-09-08 EP claimed
US-4273674-A HALOGENATED PHTHALIMIDES GENERAL ELECTRIC COMPANY (US) 1981-06-16 US claimed
US-4256507-A FLAVANTHRONE, PYRANTHRONE, INDANTHRONE, INDIGO, QUINACRIDONE, PERYLENE DIANHYDRIDE OR DIIMIDE PIGMENTS SUBSTITUTED WITH PHTHALIMIDO-METHYL GROUPS BASF AKTIENGESELLSCHAFT (DE) 1981-03-17 US claimed
EP-0014458-A1 Pigment preparations for lacquers and printing dyes BASF Aktiengesellschaft (DE) 1980-08-20 EP claimed
US-4208489-A AN ALKALI METAL SALT AND A TETRAHALOGENOPHTHALIMIDE BAYER AKTIENGESELLSCHAFT (DE) 1980-06-17 US claimed
US-4204428-A Thermal detection system for failure in electrical apparatus and thermal detecting paint compositions GENERAL ELECTRIC COMPANY (US) 1980-05-27 US claimed
US-4035383-A Eutectic process for preparing polychloro copper phthalocyanine E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-07-12 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-12365678-B2 Pharmaceutical process for the preparation of 4-{4-[(3R)-3-methylmorpholin-4-yl]-6-[1-((R)-S-methylsulfonimidoyl) cyclopropyl]pyrimidin-2-yl}-1H-pyrrolo[2,3-b] pyridine and intermediates TPMT, CYP3A7, HTR7 CYP3A4 50/4885ALDH1A1 2596/4885AHR 2676/4885
US-20250002522-A1 OLIGOSACCHARIDE COMPOUNDS AND COMPLEXES OSTC, FUT6, MAN2B2 CYP3A4 4773/4885ALDH1A1 2911/4885AHR 4513/4885

“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.