SCHEMBL185120

SCHEMBL185120

O=C=Nc1ccccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.48
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
SIGMAR1 Q99720 2/20 0.40
ALDH1A1 P00352 5/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 2/20 0.38
BCL2L1 Q07817 1/20 0.38
CYP2A6 P11509 1/20 0.38
MAPK1 P28482 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
BCAT2 O15382 1/20 0.36
PTGS2 P35354 1/20 0.35
BACE1 P56817 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
SCHEMBL29687996 1.00 CYP3A4 (0.48) CYP3A4CASP3SENP8SENP7SENP6
Methane SCHEMBL27501832 0.98 CYP3A4 (0.47) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL112824 0.86 CYP3A4 (0.56) CYP3A4ALDH1A1HSD17B10HPGDMAPK1
SCHEMBL29770893 0.86 CYP3A4 (0.44) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL692232 0.86 CYP3A4 (0.44) CYP3A4CASP3SENP8SENP7SENP6
Methane SCHEMBL29088144 0.84 CYP3A4 (0.42) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL113386 0.84 CYP3A4 (0.47) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL7585382 0.84 CYP3A4 (0.52) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL11613354 0.84 PTGS2 (0.43) CYP3A4CASP3SENP8SENP7SENP6
SCHEMBL29099802 0.84 CYP3A4 (0.54) CYP3A4ALDH1A1HSD17B10HPGDMAPK1

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 1534 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3581600-B1 RESIN LENS AND PREPARATION METHOD THEREFOR EFIRM NEW MAT CO LTD (CN) 2025-01-08 EP claimed
US-20240327352-A1 NOVEL PROCESS FOR THE PREPARATION OF 1-(2-{4-[(4-CARBAMOYLPIPERIDIN-1-YL)METHYL]- N-METHYLBENZAMIDO}ETHYL)PIPERIDIN-4-YL N-({1,1'-BIPHENYL}-2-YL)CARBAMATE MSN LABORATORIES PRIVATE LTD, R&D CENTER (IN) 2024-10-03 US claimed
US-20240332628-A1 Silicon-Based Energy Storage Devices With Electrolyte Containing Cyanate Based Compounds ENEVATE CORP (US) 2024-10-03 US claimed
CN-118599216-A Antiallergic composite material and preparation method thereof 天茂石化江苏有限公司 2024-09-06 CN claimed
CN-115787192-B Preparation method of regenerated cowhide fiber synthetic leather 峰安皮业股份有限公司 2024-08-16 CN claimed
CN-116769094-A Binuclear vanadium catalyst containing binghAC ligand, and preparation method and application thereof 合肥工业大学 2023-09-19 CN claimed
CN-116589407-A Synthesis method of 6-aryl phenanthridine compound 湖南科技学院 2023-08-15 CN claimed
CN-115093365-B Synthesis method of raffinacine 沈阳药科大学 2023-07-25 CN claimed
WO-2023002502-A1 NOVEL PROCESS FOR THE PREPARATION OF 1-(2-{4-[(4-CARBAMOYLPIPERIDIN-1-YL)METHYL]- N-METHYLBENZAMIDO}ETHYL)PIPERIDIN-4-YL N-({1,1'-BIPHENYL}-2-YL)CARBAMATE MSN LABORATORIES PRIVATE LTD, R&D CENTER (IN) 2023-01-26 WO claimed
CN-115093365-A Synthesis method of lefenacin 沈阳药科大学 2022-09-23 CN claimed
CN-101056701-A Low-viscosity microcapsule dispersions BASF AG (DE) 2007-10-17 CN claimed
CN-100335029-C Aerosol device containing a condensation polymer comprising at least polyurethane and/or polyurea unit LAYA CO LTD (FR) 2007-09-05 CN claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
CN-1292675-A Aerosol device containing a condensation polymer comprising at least polyurethane and/or polyurea unit OREAL (FR) 2001-04-25 CN claimed
CN-1275066-A Hair composition comprising a polycondensate comprising at least one polyurethane and/or polyurea unit and a polyol OREAL (FR) 2000-11-29 CN claimed
CN-1275067-A Aerosol device containing a polycondensate comprising at least one polyurethane and/or polyurea unit OREAL (FR) 2000-11-29 CN claimed
US-4607439-A AIR PERMEABLE MULTILAYER SHEET OF WATER AND OIL REPELLENT FABRIC AND RUBBER LAYER ACHILLES CORPORATION (JP) 1986-08-26 US claimed
EP-0019349-B1 STABILIZING COMPOSITION FOR POLYARYLENE ESTERS, STABILIZED POLYARYLENE ESTER, MOULDED ARTICLE PRODUCED THEREFROM AND PROCESS FOR STABILIZING A POLYARYLENE ESTER MONSANTO COMPANY (US) 1983-08-03 EP claimed
EP-0019349-A1 Stabilizing composition for polyarylene esters, stabilized polyarylene ester, moulded article produced therefrom and process for stabilizing a polyarylene ester MONSANTO COMPANY (US) 1980-11-26 EP claimed
US-4222932-A MOLDING MATERIALS STABILIZED BY ADDING AN AROMATIC ISOCYANATE AND AN ALIPHATIC PHOSPHITE MONSANTO COMPANY (US) 1980-09-16 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-20240332628-A1 Silicon-Based Energy Storage Devices With Electrolyte Containing Cyanate Based Compounds SIRT3, SLC6A12, HCN2 CYP3A4 4039/4885CASP3 1745/4885SENP8 2896/4885
US-20240327352-A1 NOVEL PROCESS FOR THE PREPARATION OF 1-(2-{4-[(4-CARBAMOYLPIPERIDIN-1-YL)METHYL]- N-METHYLBENZAMIDO}ETHYL)PIPERIDIN-4-YL N-({1,1'-BIPHENYL}-2-YL)CARBAMATE CYP4B1, CYP1B1, KDM4B CYP3A4 12/4885CASP3 704/4885SENP8 2026/4885

“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.