SCHEMBL29707233

SCHEMBL29707233

COc1cc(-n2cnc3cc(-c4ccc(Cl)cc4)sc3c2=O)ccc1OCCN1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 1.00
CHRM4 P08173 1/20 1.00
CYP3A4 P08684 1/20 1.00
CHRM5 P08912 1/20 1.00
ADRA2A P08913 1/20 1.00
CYP2D6 P10635 1/20 1.00
CHRM1 P11229 1/20 1.00
CHRM3 P20309 1/20 1.00
ADRA1D P25100 1/20 1.00
HTR1D P28221 1/20 1.00
HTR2C P28335 1/20 1.00
CYP2C19 P33261 1/20 1.00
DRD3 P35462 1/20 1.00
HTR2B P41595 1/20 1.00
HTR5A P47898 1/20 1.00
KCNH2 Q12809 1/20 1.00
TMEM97 Q5BJF2 1/20 1.00
SIGMAR1 Q99720 1/20 1.00
HRH3 Q9Y5N1 1/20 1.00

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
SCHEMBL2669495 1.00 MCHR1 (1.00) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5258406 0.96 MCHR1 (0.92) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5256418 0.95 MCHR1 (0.91) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5259118 0.92 MCHR1 (1.00) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5260769 0.92 MCHR1 (1.00) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5256326 0.92 MCHR1 (1.00) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5255718 0.90 MCHR1 (0.82) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL13738209 0.89 MCHR1 (0.80) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL5259428 0.89 MCHR1 (0.80) MCHR1CHRM4CYP3A4CHRM5ADRA2A
SCHEMBL14370191 0.89 MCHR1 (0.80) MCHR1CHRM4CYP3A4CHRM5ADRA2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558298-B1 ANTIDIABETIC SPIROCHROMAN COMPOUNDS MERCK SHARP & DOHME LLC (US) 2026-03-11 EP disclosed
US-20250346646-A1 COMPOUNDS USEFUL TO TREAT METABOLIC DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2025-11-13 US disclosed
EP-2958562-B1 ANTIDIABETIC BICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC (US) 2025-09-10 EP disclosed
CN-120091810-A Methods and highly bioavailable permeable compounds for treating viral diseases 基里尔·迪丹克 2025-06-03 CN disclosed
WO-2024155618-A1 COMPOSITIONS AND METHODS FOR TREATING WEIGHT GAIN AND/OR DISORDERS ASSOCIATED WITH ABNORMAL DE NOVO LIPOGENESIS, AND FAT ACCUMULATION CASE WESTERN RESERVE UNIVERSITY (US) 2024-07-25 WO disclosed
EP-3436003-B1 ANTIDIABETIC BICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC (US) 2023-08-23 EP disclosed
US-20220411490-A1 METHOD TO IDENTIFY COMPOUNDS USEFUL TO TREAT DYSREGULATED LIPOGENESIS, DIABETES, AND RELATED DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2022-12-29 US disclosed
CN-109642908-B Compounds useful for treating metabolic disorders 哈佛学院院长及董事 2022-08-16 CN disclosed
US-11345748-B2 Method of treating idiopathic pulmonary fibrosis and kidney fibrosis PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-05-31 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-11345748-B2 Method of treating idiopathic pulmonary fibrosis and kidney fibrosis CNR2, FABP1, FABP4 MCHR1 1809/4885CHRM4 2528/4885CYP3A4 3449/4885
US-20220411490-A1 METHOD TO IDENTIFY COMPOUNDS USEFUL TO TREAT DYSREGULATED LIPOGENESIS, DIABETES, AND RELATED DISORDERS FABP4, LIPC, CNR2 MCHR1 1571/4885CHRM4 3843/4885CYP3A4 2265/4885

“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.