SCHEMBL5227875

SCHEMBL5227875

CN1CC2CCN(Cc3ccccc3)CC2(Cc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 7/20 0.46
CHRM2 P08172 6/20 0.46
ACHE P22303 2/20 0.44
CXCR3 P49682 2/20 0.44
DRD4 P21917 1/20 0.43
GAA P10253 1/20 0.43
BCHE P06276 1/20 0.42
BACE1 P56817 1/20 0.42
NR3C1 P04150 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
SCHEMBL5228056 0.75 GPR119 (0.46) GAA
SCHEMBL5226865 0.74 LMNA (0.36) CHRM3CHRM2BCHEBACE1
SCHEMBL20411116 0.69 MC4R (0.49) CHRM3CHRM2ACHEGAA
SCHEMBL31566845 0.69 MC4R (0.45) CHRM3CHRM2ACHEGAA
SCHEMBL1620098 0.69 NR3C1 (0.46) CHRM3CHRM2ACHECXCR3DRD4
SCHEMBL13334812 0.69 NR3C1 (0.46) CHRM3CHRM2ACHECXCR3DRD4
SCHEMBL14087564 0.69 NR3C1 (0.46) CHRM3CHRM2ACHECXCR3DRD4
SCHEMBL12093988 0.69 NR3C1 (0.46) CHRM3CHRM2ACHECXCR3DRD4
SCHEMBL17137260 0.68 ACHE (0.47) CHRM3CHRM2ACHEDRD4BCHE
SCHEMBL5870766 0.68 ACHE (0.47) CHRM3CHRM2ACHEDRD4BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001970-B1 DIPEPTIDE DERIVATIVES AS GROWTH HORMONE SECRETAGOGUES PFIZER (US) 2007-03-07 EP disclosed
US-6953791-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-11 US disclosed
US-6951850-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-04 US disclosed
US-6924280-B2 Dipeptide derivatives PFIZER INC. (US) 2005-08-02 US disclosed
US-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed
US-20040009984-A1 Increasing levels of endogenous growth hormone, especially treating osterporosis, aging frailty or congestive heart failure CARPINO PHILIP ALBERT (US) 2004-01-15 US disclosed
US-20040006063-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2004-01-08 US disclosed
US-20030216399-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2003-11-20 US disclosed
US-6525047-B2 Which are growth hormone secretogogues and increase the level of endogenous growth hormone; treating osteoporosis, congestive heart failure, frailty associated with aging, obesity; accelerating bone fracture repair PFIZER INC. 2003-02-25 US disclosed
US-6432945-B1 Dipeptide derivatives PFIZER INC. 2002-08-13 US disclosed
US-6433171-B1 FOR OSTEOPOROSIS AND/OR FRAILTY, CONGESTIVE HEART FAILURE, FRAILTY ASSOCIATED WITH AGING, OBESITY; ACCELERATING BONE FRACTURE REPAIR, ATTENUATING PROTEIN CATABOLIC RESPONSE AFTER A MAJOR OPERATION, REDUCING CACHEXIA AND PROTEIN LOSS PFIZER INC. 2002-08-13 US disclosed
US-20020042415-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2002-04-11 US disclosed
US-20010041703-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2001-11-15 US disclosed
US-6251902-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2001-06-26 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 (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-20040009984-A1 Increasing levels of endogenous growth hormone, especially treating osterporosis, aging frailty or congestive heart failure GHSR, GHRHR, GIPR CHRM3 1825/4885CHRM2 1552/4885ACHE 3514/4885
US-20020042415-A1 Dipeptide derivatives GIPR, GHRHR, GHSR CHRM3 1075/4885CHRM2 1067/4885ACHE 3808/4885
US-20010041703-A1 Dipeptide derivatives GIPR, GHRHR, GHSR CHRM3 1278/4885CHRM2 1245/4885ACHE 4103/4885
US-20040006063-A1 Dipeptide derivatives GIPR, GHRHR, GHSR CHRM3 1472/4885CHRM2 1161/4885ACHE 3741/4885
US-20030216399-A1 Dipeptide derivatives GIPR, GHRHR, GHSR CHRM3 1075/4885CHRM2 1067/4885ACHE 3808/4885

“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.