Sugi Predict

Sugi Predict / Compounds / SCHEMBL266591

SCHEMBL266591

SCHEMBL266591

Cc1csc(-c2cccnc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2E1 P05181 1/20 1.00
▸ CYP3A4 P08684 1/20 1.00
▸ CYP2A6 P11509 1/20 1.00
▸ CYP2C9 P11712 1/20 1.00
▸ CYP2B6 P20813 1/20 1.00
▸ CYP19A1 P11511 5/20 0.67
▸ AXL P30530 1/20 0.67
▸ PBRM1 Q86U86 1/20 0.67
▸ MKNK1 Q9BUB5 1/20 0.67
▸ MKNK2 Q9HBH9 1/20 0.67
▸ RAB9A P51151 4/20 0.63
▸ KDM4E B2RXH2 4/20 0.63
▸ ALDH1A1 P00352 2/20 0.63
▸ NPC1 O15118 3/20 0.58
▸ CYP17A1 P05093 1/20 0.57
▸ HSD17B10 Q99714 2/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ LMNA P02545 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ MEN1 O00255 1/20 0.55

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
Hydrochloric Acid SCHEMBL11390656 0.98 CYP2E1 (0.97) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL6196239 0.80 CYP19A1 (1.00) CYP19A1AXLPBRM1MKNK1MKNK2
SCHEMBL15293861 0.80 CYP2A6 (0.65) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL11473901 0.79 RAB9A (0.77) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL87128 0.79 CYP3A4 (0.65) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL266577 0.79 CYP2E1 (0.65) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL12402375 0.79 CYP19A1 (0.67) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL14359963 0.79 CYP19A1 (0.67) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL1722906 0.79 CYP19A1 (0.67) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL9829144 0.79 CYP19A1 (0.67) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4080457-A INSECTICIDES, PESTICIDES, MITICIDES UNIROYAL CHEMICAL COMPANY, INC. 1978-03-21 — — US claimed
US-20240400577-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC 2024-12-05 — — US disclosed
WO-2023283369-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC (US) 2023-01-12 — — WO disclosed
WO-2023283369-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC (US) 2023-01-12 — — WO disclosed
US-11470846-B2 Herbicidal pyridino-/pyrimidino-thiazoles SYNGENTA PARTICIPATIONS AG (CH) 2022-10-18 — — US disclosed
CN-107001349-B Herbicidal pyrido/pyrimidothiazoles 先正达参股股份有限公司 2021-07-02 — — CN disclosed
US-20200253208-A1 HERBICIDAL PYRIDINO-/PYRIMIDINO-THIAZOLES SYNGENTA PARTICIPATIONS AG (CH) 2020-08-13 — — US disclosed
US-20200253208-A1 HERBICIDAL PYRIDINO-/PYRIMIDINO-THIAZOLES SYNGENTA PARTICIPATIONS AG (CH) 2020-08-13 — — US disclosed
US-10544133-B2 Heteroaryl substituted pyridyl compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-01-28 — — US disclosed
CN-108997325-A A kind of aryl connection thiazole compound and application 浙江工业大学 2018-12-14 — — CN disclosed
US-20050215495-A1 Macrolide antibiotics ALIHODZIC SULEJMAN 2005-09-29 — — US disclosed
WO-2005066162-A1 SYNTHETIC COMPOUNDS AND DERIVATIVES AS MODULATORS OF SMOKING OR NICOTINE INGESTION AND LUNG CANCER HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2005-07-21 — — WO disclosed
US-20050159469-A1 HIV protease inhibiting compounds ABBVIE INC. 2005-07-21 — — US disclosed
WO-2005061487-A1 HIV PROTEASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 2005-07-07 — — WO disclosed
CN-1492874-A Macrolide antibiotics — 2004-04-28 — — CN disclosed
US-5053416-A Alzheimer's disease; central cholinomimetic activity ROUSSEL UCLAF (FR) 1991-10-01 — — US disclosed
US-4260765-A APHIDICIDES UNIROYAL, INC. (US) 1981-04-07 — — US disclosed
US-4080457-A INSECTICIDES, PESTICIDES, MITICIDES UNIROYAL CHEMICAL COMPANY, INC. 1978-03-21 — — US disclosed
US-3985754-A Para-fluorobenzoylpropyl-N-heterocyclic substituted quaternary salts AMERICAN CYANAMID COMPANY (US) 1976-10-12 — — US disclosed
US-3966748-A NEUROLEPTIC, ANALGESIC AMERICAN CYANAMID COMPANY (US) 1976-06-29 — — 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 (6 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-10544133-B2 Heteroaryl substituted pyridyl compounds useful as kinase modulators IRAK4, IRAK3, IRAK2 CYP2E1 4043/4885CYP3A4 1228/4885CYP2A6 3880/4885
US-20240400577-A1 MODULATORS OF PROTEIN KINASES MAP3K20, PRKCE, PRKCH CYP2E1 4597/4885CYP3A4 4766/4885CYP2A6 4745/4885
US-20050215495-A1 Macrolide antibiotics IL1R1, MRPL12, RPS21 CYP2E1 651/4885CYP3A4 341/4885CYP2A6 522/4885
US-11470846-B2 Herbicidal pyridino-/pyrimidino-thiazoles PDXK, PLPBP, DDT CYP2E1 462/4885CYP3A4 716/4885CYP2A6 491/4885
US-20200253208-A1 HERBICIDAL PYRIDINO-/PYRIMIDINO-THIAZOLES PDXK, PLPBP, DDT CYP2E1 462/4885CYP3A4 716/4885CYP2A6 491/4885
US-20050159469-A1 HIV protease inhibiting compounds SERPINB1, HPN, DNPEP CYP2E1 2016/4885CYP3A4 764/4885CYP2A6 1882/4885

“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.