SCHEMBL4800980

SCHEMBL4800980

CON1C(=O)[C@H](NC(=O)O)Cc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PYGL P06737 17/20 0.43
PYGM P11217 14/20 0.43
LMNA P02545 1/20 0.38
AADAT Q8N5Z0 1/20 0.38

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
SCHEMBL4800991 1.00 PYGL (0.43) PYGLPYGMLMNAAADAT
SCHEMBL14193208 0.89 PYGL (0.43) PYGLPYGMAADAT
SCHEMBL4799822 0.86 MTNR1A (0.49) PYGLPYGM
SCHEMBL4799807 0.86 MTNR1A (0.49) PYGLPYGM
SCHEMBL3786087 0.84 PYGL (0.40) PYGLPYGM
SCHEMBL14193205 0.83 SLC6A2 (0.50) PYGLPYGMAADAT
SCHEMBL3785883 0.80 AADAT (0.56) PYGLPYGMAADAT
SCHEMBL20028018 0.78 RAB9A (0.47) PYGLPYGM
SCHEMBL25329972 0.76 OPRM1 (0.45) PYGLPYGMLMNA
SCHEMBL9288876 0.75 MMP1 (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE40278-E1 Heterocyclic amines having central nervous system activity PHARMACIA & UPJOHN COMPANY (US) 2008-04-29 US disclosed
US-7074927-B2 Heterocyclic amines having central nervous system activity PHARMACIA & UPJOHN COMPANY (US) 2006-07-11 US disclosed
US-20050107378-A1 Heterocyclic amines having central nervous system activity ROMERO ARTHUR G (US) 2005-05-19 US disclosed
US-RE38452-E1 SUITABLE FOR TREATING ANXIOLYTIC DISORDER, SCHIZOPHRENIA, PARKINSON'S DISEASE, ANXIETY PHARMACIA & UPJOHN COMPANY 2004-03-02 US disclosed
US-20020187981-A1 Heterocyclic amines having central nervous system activity ROMERO ARTHUR GLENN (US) 2002-12-12 US disclosed
US-20010009916-A1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY ROMERO ARTHUR G (US) 2001-07-26 US disclosed
EP-0724584-B1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY UPJOHN CO (US) 1997-11-05 EP disclosed
US-5652245-A Heterocyclic amines having central nervous system activity PHARMACIA & UPJOHN COMPANY (US) 1997-07-29 US disclosed
EP-0724584-A1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 1996-08-07 EP disclosed
WO-1995004056-A1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY THE UPJOHN COMPANY (US) 1995-02-09 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 (3 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-20010009916-A1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY CNR1, CNR2, OPRD1 PYGL 3299/4885PYGM 3678/4885LMNA 1692/4885
US-20020187981-A1 Heterocyclic amines having central nervous system activity CNR1, CNR2, OPRD1 PYGL 3290/4885PYGM 3684/4885LMNA 1718/4885
US-20050107378-A1 Heterocyclic amines having central nervous system activity CNR1, CNR2, NPY2R PYGL 3968/4885PYGM 3803/4885LMNA 2188/4885

“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.