SCHEMBL1770631

SCHEMBL1770631

CC(=O)NCCN1CCc2ccc3c(c21)CCO3

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.55
HTR2C P28335 2/20 0.55
HTR2B P41595 2/20 0.55
MTNR1A P48039 17/20 0.53
MTNR1B P49286 15/20 0.53

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 SCHEMBL8887373 0.99 HTR2A (0.54) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL8887861 0.93 HTR2A (0.57) HTR2AHTR2CHTR2BMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL8888110 0.92 HTR2A (0.56) HTR2AHTR2CHTR2BMTNR1AMTNR1B
Ammonia Solution, Strong SCHEMBL906002 0.78 HTR2C (0.64) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL8888435 0.78 MTNR1A (0.43) MTNR1AMTNR1B
Fumaric Acid SCHEMBL4824846 0.77 HTR2A (0.53) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL8888063 0.77 HTR2C (0.65) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL25882779 0.76 HTR2C (0.68) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL8888059 0.76 HTR2A (0.61) HTR2AHTR2CHTR2BMTNR1AMTNR1B
SCHEMBL7499133 0.75 HTR2A (0.62) HTR2AHTR2CHTR2BMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5633276-A MELATONIN SYSTEM DISORDERS GLAXO GROUP LIMITED (GB) 1997-05-27 US claimed
EP-0736028-A1 INDOLINE DERIVATIVES, METHOD OF PREPARATION AND THEIR USE AS PHARMACEUTICALS GLAXO GROUP LIMITED (GB) 1996-10-09 EP claimed
WO-1995017405-A1 INDOLINE DERIVATIVES, METHOD OF PREPARATION AND THEIR USE AS PHARMACEUTICALS GLAXO GROUP LIMITED (GB) 1995-06-29 WO claimed
EP-4706758-A2 METHODS FOR INHIBITING PHOSPHATE TRANSPORT Ardelyx, Inc. (US) 2026-03-11 EP 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
US-20240325487-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2024-10-03 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
EP-4346810-A1 COMPOSITIONS FOR REGULATING HOMEOSTASIS OF CORTISOL AND IMPROVING SLEEP QUALITY AND METHODS OF USE AND PRODUCTION THEREOF Unigen, Inc. (US) 2024-04-10 EP disclosed
US-20090264521-A1 Percutaneous absorption preparation SUZUKI YASUYUKI 2009-10-22 US disclosed
US-20090264521-A1 Percutaneous absorption preparation SUZUKI YASUYUKI 2009-10-22 US disclosed
WO-2009053440-A1 INDOLINE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2009-04-30 WO disclosed
EP-1696959-A2 MELATONIN COMBINATION THERAPY FOR IMPROVING SLEEP QUALITY Sepracor, Inc. (US) 2006-09-06 EP disclosed
US-20050164987-A1 Melatonin combination therapy for improving sleep quality SEPRACOR INC. 2005-07-28 US disclosed
WO-2005063297-A2 MELATONIN COMBINATION THERAPY FOR IMPROVING SLEEP QUALITY SEPRACOR INC. (US) 2005-07-14 WO disclosed
US-5633276-A MELATONIN SYSTEM DISORDERS GLAXO GROUP LIMITED (GB) 1997-05-27 US disclosed
EP-0736028-A1 INDOLINE DERIVATIVES, METHOD OF PREPARATION AND THEIR USE AS PHARMACEUTICALS GLAXO GROUP LIMITED (GB) 1996-10-09 EP disclosed
WO-1995017405-A1 INDOLINE DERIVATIVES, METHOD OF PREPARATION AND THEIR USE AS PHARMACEUTICALS GLAXO GROUP LIMITED (GB) 1995-06-29 WO 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 (5 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-20090264521-A1 Percutaneous absorption preparation MTNR1A, MTNR1B, NPSR1 HTR2A 108/4885HTR2C 277/4885HTR2B 150/4885
US-12201604-B2 Treatment of circadian rhythm disorders CRY1, PER2, CRY2 HTR2A 39/4885HTR2C 69/4885HTR2B 63/4885
US-20240156775-A1 TREATMENT OF CIRCADIAN RHYTHM DISORDERS CRY1, PER2, CRY2 HTR2A 39/4885HTR2C 69/4885HTR2B 63/4885
US-20240325487-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A3, SLC34A2, SLC34A1 HTR2A 3098/4885HTR2C 2807/4885HTR2B 2477/4885
US-20050164987-A1 Melatonin combination therapy for improving sleep quality MTNR1A, MTNR1B, CRY1 HTR2A 11/4885HTR2C 31/4885HTR2B 120/4885

“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.