SCHEMBL1339705

SCHEMBL1339705

O=C1CCCc2cccc(Cl)c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.50
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
CYP2A6 P11509 1/20 0.48
POLB P06746 1/20 0.43
BRD4 O60885 1/20 0.42
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PRKCI P41743 1/20 0.39
AHR P35869 1/20 0.39
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38
FGFR4 P22455 1/20 0.38
FGFR3 P22607 1/20 0.38
NOTUM Q6P988 1/20 0.38
MAPT P10636 2/20 0.37
SRC P12931 1/20 0.37
GRM5 P41594 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL12430502 0.96 DYRK1A (0.46) DYRK1AMAOAMAOBCYP2A6POLB
SCHEMBL568118 0.88 AHR (0.41) DYRK1ACYP2A6AHRNOTUMMAPT
SCHEMBL9822419 0.80 DYRK1A (0.41) DYRK1APOLBBRD4AHRMAPT
SCHEMBL5537592 0.78 MAOA (0.50) DYRK1AMAOAMAOBCYP2A6BRD4
SCHEMBL20589092 0.77 AHR (0.47) MAOAMAOBCYP1A2AHRMAPT
SCHEMBL5238902 0.76 MAOA (0.48) DYRK1AMAOAMAOBCYP2A6PRKCI
SCHEMBL2564157 0.76 MAPT (0.52) DYRK1AMAOAMAOBCYP2A6BRD4
SCHEMBL19899072 0.76 MAOA (0.48) DYRK1AMAOAMAOBCYP2A6BRD4
SCHEMBL1337967 0.76 CYP2A6 (0.48) MAOAMAOBCYP2A6BRD4FGFR1
SCHEMBL14632127 0.76 MAOA (0.48) DYRK1AMAOAMAOBCYP2A6BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12209092-B2 Inhibitors of GLI1 as therapeutic agents NEW YORK UNIVERSITY (US) 2025-01-28 US disclosed
CN-117740961-A Compound analysis method of liquorice and liquorice probiotics fermentation preparation 北京中医药大学 2024-03-22 CN disclosed
CN-117466723-A Preparation method of halogenated tetralone 上海泰坦科技股份有限公司 2024-01-30 CN disclosed
EP-3423431-B1 CARBAMATE DERIVATIVE COMPOUNDS AND THEIR USES BIO PHARM SOLUTIONS CO LTD (KR) 2023-11-29 EP disclosed
EP-3423431-B1 CARBAMATE DERIVATIVE COMPOUNDS AND THEIR USES BIO PHARM SOLUTIONS CO LTD (KR) 2023-11-29 EP disclosed
EP-4209492-A1 COMPOUND FOR TREATING THROMBOTIC DISEASES Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2023-07-12 EP disclosed
EP-4209492-A1 COMPOUND FOR TREATING THROMBOTIC DISEASES Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2023-07-12 EP disclosed
EP-3883932-B1 INHIBITORS OF GLI1 AS THERAPEUTIC AGENTS UNIV NEW YORK (US) 2023-03-29 EP disclosed
CN-113968855-A Compound for treating thrombotic diseases 中国科学院上海药物研究所 2022-01-25 CN disclosed
US-20220009935-A1 INHIBITORS OF GLI1 AS THERAPEUTIC AGENTS NEW YORK UNIVERSITY 2022-01-13 US disclosed
US-5646173-A ANTISEROTONINE AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1997-07-08 US disclosed
EP-0606661-B1 Octahydrophenanthrene derivatives and their use as NMDA-Antagonists HOFFMANN LA ROCHE (CH) 1997-03-12 EP disclosed
CN-1105989-A Tricyclic 1-aminoethylpyrrol derivative HOFFMANN LA ROCHE (CH) 1995-08-02 CN disclosed
EP-0657426-A2 Tricyclic pyrrole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1995-06-14 EP disclosed
US-5385947-A For prevention of nerve damage due to reduction of blood or oxygen supplies HOFFMANN-LA ROCHE INC. (US) 1995-01-31 US disclosed
EP-0606661-A1 Octahydrophenanthrene derivatives and their use as NMDA-Antagonists F. HOFFMANN-LA ROCHE AG (CH) 1994-07-20 EP disclosed
EP-0591582-A1 Hexahydrobenzo (f) quinolinones as 5-alpha-reductase inhibitors ELI LILLY AND COMPANY (US) 1994-04-13 EP disclosed
US-5250539-A 5-alpha reductase inhibitors; administer as therapy for benign prostatic hyperplasia, hirsutism and acne ELI LILLY AND COMPANY (US) 1993-10-05 US disclosed
EP-0531026-A1 Hexahydrobenzo[f]quinolinones as 5-alpha-reductase inhibitors ELI LILLY AND COMPANY (US) 1993-03-10 EP disclosed
US-4016281-A Tetralone and indanone compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-04-05 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 (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-12209092-B2 Inhibitors of GLI1 as therapeutic agents GLI1, GLI2, SHH DYRK1A 3858/4885MAOA 4212/4885MAOB 4015/4885
US-20220009935-A1 INHIBITORS OF GLI1 AS THERAPEUTIC AGENTS GLI1, GLI2, SHH DYRK1A 3858/4885MAOA 4212/4885MAOB 4015/4885

“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.