SCHEMBL342256

SCHEMBL342256

COc1cc2c(CCNC(C)=O)c[nH]c2cc1OS(=O)(=O)O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 17/20 0.82
MTNR1B P49286 16/20 0.82
CYP1A2 P05177 5/20 0.70
CYP3A4 P08684 4/20 0.70
CYP2D6 P10635 4/20 0.70
KDM4E B2RXH2 3/20 0.70
HPGD P15428 3/20 0.70
HSD17B10 Q99714 2/20 0.70
NPSR1 Q6W5P4 2/20 0.70
APEX1 P27695 1/20 0.70
HTR2B P41595 3/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
LMNA P02545 1/20 0.69
CYP2C9 P11712 1/20 0.69
NFKB1 P19838 1/20 0.69
MAPK1 P28482 1/20 0.69
SLC6A4 P31645 1/20 0.69
CYP2C19 P33261 1/20 0.69
THPO P40225 1/20 0.69

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
SCHEMBL1773582 0.91 MTNR1A (1.00) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL342184 0.89 MTNR1A (0.79) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
Sulfuric Acid SCHEMBL2468595 0.85 MTNR1A (0.91) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL9189819 0.82 MTNR1A (0.91) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL29575897 0.82 MTNR1A (1.00) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL674970 0.82 MTNR1A (1.00) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL8041780 0.82 MTNR1A (0.83) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL31543696 0.82 MTNR1A (0.91) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL8053222 0.81 MTNR1A (0.81) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL6949528 0.81 MTNR1A (0.81) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2009519467-A 2009-05-14 JP claimed
EP-1960775-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-08-27 EP claimed
WO-2007089328-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2007-08-09 WO claimed
US-20070167853-A1 System and method for monitoring health using exhaled breath UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2007-07-19 US claimed
US-20250369953-A1 METHODS FOR MEASURING CIRCADIAN RHYTHM FACTORS RAIEWSKI EVAN (US) 2025-12-04 US disclosed
EP-4591063-A1 DEVICE, METHOD AND SYSTEM FOR DIAGNOSING, MONITORING AND PREDICTING CHRONIC HEALTH CONDITIONS THROUGH URINE BIOMARKERS Herstasis Health Foundation (CA) 2025-07-30 EP disclosed
EP-4463011-A1 CHRONOBIOLOGICAL FOOD FOR INFANTS AND METHOD FOR PRODUCING SAME Paditz, Ekkehart (DE) 2024-11-20 EP disclosed
WO-2024059934-A1 DEVICE, METHOD AND SYSTEM FOR DIAGNOSING, MONITORING AND PREDICTING CHRONIC HEALTH CONDITIONS THROUGH URINE BIOMARKERS HERSTASIS HEALTH FOUNDATION (CA) 2024-03-28 WO disclosed
CN-117487686-A Selection and use of melatonin supporting bacteria to reduce colic in infants 生命大地女神有限公司 2024-02-02 CN disclosed
WO-2024003412-A1 METHODS FOR DETERMINING IMPAIRMENTS IN NEURO-METABOLISM IN A SUBJECT IN NEED THEREOF & MEANS USEFUL IN THE TREATMENT THEREOF HEALTHY-LONGER GMBH (CH) 2024-01-04 WO disclosed
CN-112236513-B Selection and use of melatonin supporting bacteria to reduce colic in infants 生命大地女神有限公司 2023-09-19 CN disclosed
WO-2023134856-A1 INFANT FOOD AND METHOD FOR PRODUCING SAME PADITZ EKKEHART (DE) 2023-07-20 WO disclosed
EP-1960775-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-08-27 EP disclosed
US-20070203448-A1 System and method for monitoring health using exhaled breath UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2007-08-30 US disclosed
WO-2007089328-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2007-08-09 WO disclosed
US-20070167853-A1 System and method for monitoring health using exhaled breath UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2007-07-19 US disclosed
US-6833383-B2 Administering melatonin for therapy of dependence on, tolerance of, or addiction to at least one benzodiazepine compound NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2004-12-21 US disclosed
US-20030040539-A1 Methods for treating patients suffering from drug dependencies which lead to plasma melatonin deficiencies NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2003-02-27 US disclosed
US-20020156121-A1 Methods for treating patients suffering from drug dependencies which leads to plasma melatonin deficiencies NEURIM PHARMACEUTICALS 2002-10-24 US disclosed
US-6469044-B1 CONTROLLED RELEASE FORM OF MELATONIN PREVENTS SUSCEPTIBLE PATIENT FROM BECOMING DEPENDENT ON, TOLERANT OF, OR ADDICTED TO BENZODIAZEPINES DURING TREATMENT NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2002-10-22 US disclosed