SCHEMBL29477258

SCHEMBL29477258

COc1cccc2c1CC(CNC(C)=O)C2

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 15/20 0.55
MTNR1B P49286 14/20 0.55
CYP19A1 P11511 1/20 0.52
CYP1A2 P05177 1/20 0.49
MAPT P10636 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ACHE P22303 1/20 0.46
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45

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
SCHEMBL6638097 0.85 MTNR1A (0.67) MTNR1AMTNR1B
SCHEMBL7281450 0.79 MTNR1A (0.68) MTNR1AMTNR1B
SCHEMBL9376505 0.79 CYP19A1 (0.56) MTNR1AMTNR1BCYP19A1CYP1A2MAPT
SCHEMBL15881462 0.76 CYP19A1 (0.52) MTNR1AMTNR1BCYP19A1CYP1A2MAPT
SCHEMBL12635376 0.75 MTNR1A (0.52) MTNR1AMTNR1BCYP1A2MAPTCYP2C9
SCHEMBL25604514 0.74 MTNR1A (0.53) MTNR1AMTNR1BCYP1A2MAPTCYP2C9
SCHEMBL19962308 0.74 CYP19A1 (0.59) CYP19A1CHRM2CHRM1CHRM3
SCHEMBL12634890 0.73 CHRM2 (0.60) MTNR1AMTNR1BCYP1A2MAPTCYP2C9
SCHEMBL6634278 0.73 MTNR1A (0.69) MTNR1AMTNR1B
SCHEMBL6634680 0.73 MTNR1A (0.52) MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116593851-B Test method and test system for MOS transistor gate oxide capacitance CHANGXIN MEMORY TECHNOLOGIES, INC. (CN) 2026-05-26 CN claimed
CN-116593851-A Test method and test system for MOS transistor gate oxide capacitance 长鑫存储技术有限公司 2023-08-15 CN claimed
CN-116593851-B Test method and test system for MOS transistor gate oxide capacitance CHANGXIN MEMORY TECHNOLOGIES, INC. (CN) 2026-05-26 CN disclosed
EP-4502609-A2 DETERMINING A CIRCADIAN RHYTHM Vanda Pharmaceuticals Inc. (US) 2025-02-05 EP disclosed
US-12201604-B2 Treatment of circadian rhythm disorders VANDA PHARMACEUTICALS INC. (US) 2025-01-21 US disclosed
US-20240390327-A1 THERAPEUTIC COMPOSITIONS AND METHODS JOHNS HOPKINS UNIVERSITY (US) 2024-11-28 US disclosed
WO-2024155777-A2 COMPOSITIONS AND TECHNIQUES FOR TREATMENT OF POLYCYSTIC OVARIAN SYNDROME (PCOS) AND ENDOMETRIOSIS DARE BIOSCIENCE, INC. (US) 2024-07-25 WO disclosed
US-20240156775-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS VANDA PHARMACEUTICALS INC. 2024-05-16 US disclosed
US-11918557-B2 Treatment of circadian rhythm disorders VANDA PHARMACEUTICALS INC. (US) 2024-03-05 US disclosed
US-11845990-B2 Prediction of sleep parameter and response to sleep-inducing compound based on PER3 VNTR genotype VANDA PHARMACEUTICALS INC. (US) 2023-12-19 US disclosed
CN-116593851-A Test method and test system for MOS transistor gate oxide capacitance 长鑫存储技术有限公司 2023-08-15 CN disclosed
US-20230210810-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS VANDA PHARMACEUTICALS INC. 2023-07-06 US disclosed
US-11633377-B2 Treatment of circadian rhythm disorders VANDA PHARMACEUTICALS INC. (US) 2023-04-25 US disclosed
US-11600045-B2 Collaborative light show authoring for tessellated geometries CONTRAVENTUM, LLC (US) 2023-03-07 US disclosed
US-20220366648-A1 Collaborative Light Show Authoring for Tessellated Geometries CONTRAVENTUM, LLC (US) 2022-11-17 US disclosed
WO-2022183083-A1 THERAPEUTIC COMPOSITIONS AND METHODS THE JOHNS HOPKINS UNIVERSITY (US) 2022-09-01 WO disclosed
US-11282276-B2 Collaborative light show authoring for tessellated geometries CONTRAVENTUM, LLC (US) 2022-03-22 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-12201604-B2 Treatment of circadian rhythm disorders CRY1, PER2, CRY2 MTNR1A 4/4885MTNR1B 5/4885CYP19A1 732/4885
US-20240156775-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS CRY1, PER2, CRY2 MTNR1A 4/4885MTNR1B 5/4885CYP19A1 732/4885
US-20230210810-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS CRY1, PER2, CRY2 MTNR1A 4/4885MTNR1B 5/4885CYP19A1 732/4885
US-11845990-B2 Prediction of sleep parameter and response to sleep-inducing compound based on PER3 VNTR genotype PER2, CRY1, NR1I3 MTNR1A 13/4885MTNR1B 37/4885CYP19A1 1926/4885
US-11633377-B2 Treatment of circadian rhythm disorders CRY1, PER2, CRY2 MTNR1A 4/4885MTNR1B 5/4885CYP19A1 732/4885
US-11918557-B2 Treatment of circadian rhythm disorders CRY1, PER2, CRY2 MTNR1A 4/4885MTNR1B 5/4885CYP19A1 732/4885

“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.