SCHEMBL8548879

SCHEMBL8548879

c1cc2c(c(C3CCNCC3)c1)OCCO2

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.50
HTR1A P08908 11/20 0.49
HTR2C P28335 8/20 0.47
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL12081257 0.87 HTR2C (0.47) HTR1AHTR2CSLC6A2SLC6A4SLC6A3
Methyl Alcohol SCHEMBL27462714 0.83 HTR1A (0.54) HTR1A
Methylamine SCHEMBL27483381 0.83 HTR1A (0.51) ADRB1HTR1A
SCHEMBL9934153 0.79 HTR2C (0.46) HTR2C
SCHEMBL614437 0.79 HTR1A (0.46) HTR1AHTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL9715368 0.78 EED (0.51) HTR1AHTR2C
SCHEMBL27449991 0.78 HTR2C (0.45) HTR1AHTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL26005486 0.74 HTR2C (0.45) HTR1AHTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL26005718 0.74 HTR2C (0.49) HTR1AHTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL16309063 0.74 L3MBTL1 (0.47) ADRB1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295154-A1 HETEROCYCLIC GLP-1 AGONISTS SHOUTI INC. 2023-09-21 US disclosed
EP-0711291-B1 N-(PIPERIDINYL-1-ALKYL)-SUBSTITUTED CYCLOHEXANE CARBOXYLIC ACID AMIDES AS 5-HT1A RECEPTOR ANTAGONISTS WYETH JOHN & BROTHER LTD (GB) 1998-11-25 EP disclosed
US-5763460-A N-(piperidinyl-1-alkyl)-substituted cyclohexane carboxylic acid amides as 5-htia receptor antagonists JOHN WYETH & BROTHER LIMITED (US) 1998-06-09 US disclosed
EP-0711291-A1 N-(PIPERIDINYL-1-ALKYL)-SUBSTITUTED CYCLOHEXANE CARBOXYLIC ACID AMIDES AS 5-HT1A RECEPTOR ANTAGONISTS JOHN WYETH & BROTHER LIMITED (GB) 1996-05-15 EP disclosed
WO-1995002592-A1 N-(PIPERIDINYL-1-ALKYL)-SUBSTITUTED CYCLOHEXANE CARBOXYLIC ACID AMIDES AS 5-HT1A RECEPTOR ANTAGONISTS JOHN WYETH & BROTHER LTD. (GB) 1995-01-26 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 (1 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-20230295154-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR ADRB1 101/4885HTR1A 52/4885HTR2C 160/4885

“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.