SCHEMBL7219031

SCHEMBL7219031

CCCc1cc(C#N)ccn1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
LMNA P02545 1/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 1/20 0.49
CTSK P43235 6/20 0.47
CTSS P25774 3/20 0.47
MBOAT4 Q96T53 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP19A1 P11511 2/20 0.41
HRH4 Q9H3N8 1/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
SREBF2 Q12772 3/20 0.39
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL4963448 0.89 MBOAT4 (0.40) KDM4ELMNACYP3A4TSHRCTSK
SCHEMBL17843154 0.85 CCNC (0.41) KDM4ELMNACYP3A4TSHRCTSK
SCHEMBL3242600 0.85 CYP1A2 (0.44) CTSKCTSSMBOAT4CCNCCDK8
SCHEMBL3870198 0.81 CCNC (0.40) KDM4ELMNACYP3A4TSHRMBOAT4
SCHEMBL3869976 0.81 CCNC (0.40) LMNAMBOAT4CYP19A1CCNCCDK8
SCHEMBL22637777 0.81 MBOAT4 (0.39) MBOAT4CYP19A1CCNCCDK8
SCHEMBL6644862 0.78 MBOAT4 (0.40) LMNAMBOAT4MEN1KMT2AHRH4
SCHEMBL25087065 0.78 LOXL2 (0.46) LMNACYP3A4TSHRMBOAT4CCNC
SCHEMBL13738243 0.77 CCNC (0.37) KDM4ELMNACYP3A4TSHRMBOAT4
SCHEMBL22637846 0.77 MBOAT4 (0.44) KDM4EMBOAT4HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119100978-A Method for preparing 2-propylthioisonicotinamide intermediate through continuous pipeline 苏州开元民生科技股份有限公司 2024-12-10 CN claimed
CN-115629139-B Method for determining impurity content in isonicotinamide by utilizing HPLC 江苏慈星药业有限公司 2024-08-02 CN claimed
CN-117185998-B Preparation method of 2-propylthioisonicotinamide 苏州开元民生科技股份有限公司 2024-01-05 CN claimed
CN-117185998-A Preparation method of 2-propylthioisonicotinamide 苏州开元民生科技股份有限公司 2023-12-08 CN claimed
CN-115629139-A Method for determining content of impurities in propylthioisoniazid by using HPLC (high performance liquid chromatography) 江苏慈星药业有限公司 2023-01-20 CN claimed
CN-114105869-B Preparation method of 2-propyl-4-cyanopyridine 苏州开元民生科技股份有限公司 2022-11-08 CN claimed
CN-114105869-A Preparation method of 2-propyl-4-cyanopyridine 苏州开元民生科技股份有限公司 2022-03-01 CN claimed
EP-4121423-B1 TETRAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2026-04-29 EP disclosed
EP-4121429-B1 CONDENSED PYRIDINE DERIVATIVES SUBSTITUED BY AMIDE FUNCTIONS AS ACSS2 INHIBITORS MERCK PATENT GMBH (DE) 2025-08-13 EP disclosed
CN-115335371-B Tetrazole derivatives 默克专利股份公司 2024-12-27 CN disclosed
CN-119100978-A Method for preparing 2-propylthioisonicotinamide intermediate through continuous pipeline 苏州开元民生科技股份有限公司 2024-12-10 CN disclosed
CN-119100978-A Method for preparing 2-propylthioisonicotinamide intermediate through continuous pipeline 苏州开元民生科技股份有限公司 2024-12-10 CN disclosed
US-20240382468-A2 TETRAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2024-11-21 US disclosed
CN-114105869-A Preparation method of 2-propyl-4-cyanopyridine 苏州开元民生科技股份有限公司 2022-03-01 CN disclosed
WO-2021185789-A1 CONDENSED PYRIDINE DERIVASTIVES SUBSTITUED BY AMIDE FUNCTIONS AS ACSS2 INHIBITORS MERCK PATENT GMBH (DE) 2021-09-23 WO disclosed
WO-2021185793-A1 TETRAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2021-09-23 WO disclosed
EP-2922841-B1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2017-06-07 EP disclosed
WO-2012122077-A1 PRIMARY AMINE DIAZENIUMDIOLATE HETEROCYCLIC DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2012-09-13 WO disclosed
US-6603007-B1 Intermediates in the fields of pharmaceuticals, agrichemicals, ligands, silver halide photosensitive materials, liquid crystals, surfactants, electrophotography and organic electroluminescence SANKIO CHEMICAL CO., LTD. (JP) 2003-08-05 US disclosed
EP-1231207-A1 NOVEL BIPYRIDYL DERIVATIVES Sankio Chemical Co., Ltd. (JP) 2002-08-14 EP 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-20240382468-A2 TETRAZOLE DERIVATIVES VHL, BRCA1, POT1 KDM4E 4514/4885LMNA 2616/4885CYP3A4 2279/4885

“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.