SCHEMBL876345

SCHEMBL876345

COc1cccc(CCNC(C)=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.83
MTNR1B P49286 6/20 0.83
SMN1; SMN2 Q16637 1/20 0.67
CHRM2 P08172 1/20 0.64
CHRM1 P11229 1/20 0.64
CHRM3 P20309 1/20 0.64
CNR1 P21554 1/20 0.62
RAB9A P51151 1/20 0.61
ALDH1A1 P00352 1/20 0.61
POLB P06746 1/20 0.61

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
SCHEMBL8928104 0.91 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL8928132 0.90 MTNR1A (0.92) MTNR1AMTNR1B
SCHEMBL17143946 0.89 ALDH1A1 (0.74) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL3690675 0.88 MTNR1A (0.65) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL2205978 0.88 MTNR1A (0.65) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL875811 0.86 MTNR1A (0.63) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL11654998 0.85 CA1 (0.77) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL10516559 0.85 ALDH1A1 (0.65) MTNR1AMTNR1BCHRM2CHRM1CHRM3
SCHEMBL330142 0.85 ALDH1A1 (0.76) MTNR1AMTNR1BSMN1; SMN2CHRM2CHRM1
SCHEMBL13853575 0.85 CNR1 (0.67) MTNR1AMTNR1BCHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092061-A1 COMPOUNDS FOR TARGETED PROTEIN DEGRADATION AMPHISTA THERAPEUTICS LTD (GB) 2026-04-02 US disclosed
US-12577267-B2 Pyrimidine compounds for use as MAP4K1 inhibitors GLENMARK SPECIALITY S.A. (CH) 2026-03-17 US disclosed
US-12454511-B2 6-methoxy-3,4-dihydro-1H-isoquinolin compounds ELI LILLY AND COMPANY (US) 2025-10-28 US disclosed
EP-4587126-A1 COMPOUNDS FOR TARGETED PROTEIN DEGRADATION Amphista Therapeutics Ltd (GB) 2025-07-23 EP disclosed
US-11993591-B2 Chromen-4-one derivatives for the treatment and prophylaxis of hepatitis B virus disease HOFFMANN-LA ROCHE INC. (US) 2024-05-28 US disclosed
EP-4367123-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS Glenmark Specialty S.A. (CH) 2024-05-15 EP disclosed
US-20240115711-A1 Novel Bifunctional Molecules For Targeted Protein Degradation AMPHISTA THERAPEUTICS LIMITED (GB) 2024-04-11 US disclosed
WO-2024057021-A1 COMPOUNDS FOR TARGETED PROTEIN DEGRADATION AMPHISTA THERAPEUTICS LIMITED (GB) 2024-03-21 WO disclosed
CN-117730083-A Pyrimidine compounds as MAP4K1 inhibitors 格兰马克专业公司 2024-03-19 CN disclosed
US-11918582-B2 Pyrazole pyrimidine compounds and uses thereof RAPT THERAPEUTICS, INC. (US) 2024-03-05 US disclosed
EP-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed
EP-1129076-A1 TETRAHYDROISOQUINOLINE DERIVATIVES AS LHRH ANTAGONISTS ABBOTT LABORATORIES (US) 2001-09-05 EP disclosed
EP-1015444-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION, LTD. (KR) 2000-07-05 EP disclosed
WO-2000029380-A1 TETRAHYDROISOQUINOLINE DERIVATIVES AS LHRH ANTAGONISTS ABBOTT LABORATORIES (US) 2000-05-25 WO disclosed
US-5981521-A USEFUL FOR TREATING VARIOUS HORMONE DEPENDENT DISEASES, INCLUDING PROSTATE CANCER, ENDOMETRIOSIS, UTERINE FIBROIDS, PRECOCIOUS PUBERTY, BENIGN PROSTATE HYPERTROPY AND IN VITRO FERTILIZATION ABBOTT LABORATORIES (US) 1999-11-09 US disclosed
WO-1998043968-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1998-10-08 WO disclosed
US-5294621-A Thieno tetrahydropyridines useful as class III antiarrhythmic agents ORTHO PHARMACEUTICAL CORPORATION (US) 1994-03-15 US disclosed
US-4766131-A 2-amino (or hydroxy) phenethyl-1,2,3,4-tetrahydroisoquinolines as analgesics PENNWALT CORPORATION (US) 1988-08-23 US disclosed
EP-0051190-A2 N-(amino(or hydroxy) phenethyl)-1,2,3,4-tetrahydroisoquinolines, precursors thereof, and methods of preparation PENNWALT CORPORATION (US) 1982-05-12 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 (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-11918582-B2 Pyrazole pyrimidine compounds and uses thereof DCK, MCL1, DTYMK MTNR1A 3892/4885MTNR1B 3345/4885SMN1; SMN2 3801/4885
US-12577267-B2 Pyrimidine compounds for use as MAP4K1 inhibitors PTK2B, MAP3K10, MAP3K20 MTNR1A 3474/4885MTNR1B 3269/4885SMN1; SMN2 2229/4885
US-11993591-B2 Chromen-4-one derivatives for the treatment and prophylaxis of hepatitis B virus disease HAVCR2, CYP7A1, CYP26B1 MTNR1A 335/4885MTNR1B 350/4885SMN1; SMN2 2875/4885
US-20260092061-A1 COMPOUNDS FOR TARGETED PROTEIN DEGRADATION BCL9L, RBBP9, BRD9 MTNR1A 3557/4885MTNR1B 2853/4885SMN1; SMN2 3996/4885
US-20240115711-A1 Novel Bifunctional Molecules For Targeted Protein Degradation PSMG3, MYCBP2, PSME2 MTNR1A 4073/4885MTNR1B 4150/4885SMN1; SMN2 2781/4885
US-12454511-B2 6-methoxy-3,4-dihydro-1H-isoquinolin compounds GLP1R, GIPR, GPR119 MTNR1A 66/4885MTNR1B 46/4885SMN1; SMN2 2958/4885

“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.