SCHEMBL75570

SCHEMBL75570

c1ccc(-n2ccnn2)cc1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.63
KEAP1 Q14145 1/20 0.60
CYP19A1 P11511 3/20 0.49
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL29084866 0.98 NOTUM (0.61) NOTUMKEAP1CYP19A1CYP3A4CYP2C9
Azobenzene SCHEMBL21956057 0.88 NOTUM (0.52) NOTUMKEAP1CYP19A1
SCHEMBL10447781 0.87 NOTUM (0.78) NOTUMKEAP1CYP19A1
SCHEMBL26156419 0.87 NOTUM (0.60) NOTUMKEAP1CYP19A1
SCHEMBL14961974 0.84 NOTUM (0.75) NOTUMKEAP1CYP19A1
Quinoline SCHEMBL27588058 0.82 ALDH1A1 (0.55) NOTUMKEAP1CYP19A1CYP3A4
Tromethamine SCHEMBL17472522 0.82 NOTUM (0.46) NOTUMKEAP1CYP19A1
SCHEMBL4808980 0.81 NOTUM (0.63) NOTUMKEAP1CYP19A1
SCHEMBL4803886 0.79 NOTUM (0.53) NOTUMKEAP1CYP19A1CYP3A4
SCHEMBL28167460 0.78 NOTUM (0.53) NOTUMKEAP1CYP2C9

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 1565 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658641-A1 NOVEL COMPOUNDS THAT CAN BE USED AS THERAPEUTIC AGENTS Xeniom GmbH (DE) 2025-12-10 EP claimed
US-20250213558-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING A PIPERAZINE OR 1,4-DIAZEPANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. 2025-07-03 US claimed
WO-2025069012-A1 A NOVEL METHOD AND AUTOMATED DEVICE FOR INTELLIGENT COLOR/SHAPE CHANGEABLE MOLECULAR PRINTING, WITH MULTIFUNCTIONAL INTEGRATED MECHANISMS, ON VARIOUS TEXTILE-BASED SURFACES ASHOURI SINA (IR) 2025-04-03 WO claimed
CN-119278038-A T-type calcium channel modulators comprising piperazine or 1, 4-diazacycloheptane cores and methods of use thereof 普拉西斯精密医药公司 2025-01-07 CN claimed
WO-2024161041-A1 NOVEL COMPOUNDS THAT CAN BE USED AS THERAPEUTIC AGENTS XENIOM GMBH (DE) 2024-08-08 WO claimed
CN-118244583-A Negative photosensitive polyimide precursor resin composition 深圳先进电子材料国际创新研究院 2024-06-25 CN claimed
CN-118240213-A Negative photosensitive polyimide precursor and composition thereof 深圳先进电子材料国际创新研究院 2024-06-25 CN claimed
US-20240124770-A1 COMPOUND, GUEST MATERIAL OF LIGHT-EMITTING LAYER, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE BEIJING NORMAL UNIVERSITY (CN) 2024-04-18 US claimed
EP-4301816-A1 COATING COMPOSITIONS COMPRISING A POLYSULFIDE CORROSION INHIBITOR PRC-Desoto International, Inc. (US) 2024-01-10 EP claimed
CN-117377727-A Coating composition comprising polysulfide corrosion inhibitor PRC-迪索托国际公司 2024-01-09 CN claimed
CN-1036304-C Phenyltriazole derivatives and insecticides KUMIAI CHEMICAL INDUSTRY CO (JP) 1997-11-05 CN claimed
US-5646198-A MIXTURE INCLUDES POLYMER, BENZOTRIAZOLE OR TRIAZOLE COMPOUND, AND COMPOUND WITH HYDROPHOBIC AND HYDROPHILIC PARTS; STORAGE STABILITY; MARINE STRUCTURES HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-07-08 US claimed
US-5104919-A With curing retardant or flame retardant triazole compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1992-04-14 US claimed
EP-0285893-B1 PHENYLTRIAZOLE DERIVATIVE AND INSECTICIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1992-03-18 EP claimed
US-4957935-A Phenyltriazole derivative and insecticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-09-18 US claimed
US-4925864-A Phenyltriazole derivative and insecticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-05-15 US claimed
CN-88101620-A phenyl triazole derivatives and insecticides 1988-10-19 CN claimed
EP-0285893-A2 Phenyltriazole derivative and insecticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-10-12 EP claimed
US-4336377-A Basic dioxazine compounds CIBA-GEIGY CORPORATION (US) 1982-06-22 US claimed
US-3952334-A Biocompatible carbon prosthetic devices GENERAL ATOMIC COMPANY (US) 1976-04-27 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 (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-20250213558-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING A PIPERAZINE OR 1,4-DIAZEPANE CORE AND METHODS OF USE THEREOF CACNA1G, CACNA1I, CACNA1H NOTUM 3060/4885KEAP1 1841/4885CYP19A1 4000/4885

“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.