SCHEMBL10123829

SCHEMBL10123829

CCN1CCN(c2ncc3c(=O)c(C(=O)O)cn(CC)c3n2)CC1

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.83
CASP1 P29466 1/20 0.83
KDM4E B2RXH2 6/20 0.66
MAPK1 P28482 3/20 0.66
CYP2C9 P11712 1/20 0.66
ENPP2 Q13822 11/20 0.65
MEN1 O00255 1/20 0.65
ALDH1A1 P00352 1/20 0.65
HPGD P15428 1/20 0.65
KMT2A Q03164 1/20 0.65
HSD17B10 Q99714 1/20 0.65
NPSR1 Q6W5P4 1/20 0.63
TDP1 Q9NUW8 1/20 0.62

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
SCHEMBL11582970 0.93 LMNA (0.78) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL11583599 0.92 LMNA (0.77) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL11582405 0.91 LMNA (0.83) LMNACASP1KDM4EMAPK1CYP2C9
Piromidic Acid SCHEMBL134848 0.91 LMNA (1.00) LMNACASP1KDM4EMAPK1CYP2C9
Piromidic Acid SCHEMBL29479929 0.91 LMNA (1.00) LMNACASP1KDM4EMAPK1CYP2C9
Piromidic Acid SCHEMBL7759092 0.90 LMNA (0.98) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL26193584 0.90 LMNA (0.98) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL11584216 0.90 LMNA (0.74) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL11878462 0.90 LMNA (0.74) LMNACASP1KDM4EMAPK1CYP2C9
SCHEMBL11875351 0.89 LMNA (0.80) LMNACASP1KDM4EMAPK1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3950338-A BACTERICIDES LABORATOIRE ROGER BELLON (FR) 1976-04-13 US claimed
US-8101782-B2 Drug hybrid of rivastigmine or physostigmine with tranylcypromine, amoxapine, desipramine, nortriptyline, protriptyline, fluoxetine, fluvoxamine, paroxetine, duloxetine, betahistine, amlodipine, proylhexedrine, rimantadine, desloratadine; Alzheimer's disease; Parkinson's disease, impairment in memory COLUCID PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20080261950-A1 Compounds that inhibit cholinesterase COLUCID PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
US-4129737-A Process for the preparation of an 8-alkyl-5-oxo-5,8-dihydro-pyrido(2,3-d)pyrimidine-6-carboxylic acid LABORATOIRE ROGER BELLON (FR) 1978-12-12 US disclosed
US-4034094-A 8-Alkyl-5-oxo-5,8-dihydro-pyrido(2,3-d)pyrimidine-6-carboxylic acids for treating urinary tract infections LABORATOIRE ROGER BELLOW (FR) 1977-07-05 US disclosed
US-3962443-A Antibacterial pharmaceutical compositions and processes for preparation thereof DAINIPPON PHARMACEUTICAL CO., LTD. (JA) 1976-06-08 US disclosed
US-3950338-A BACTERICIDES LABORATOIRE ROGER BELLON (FR) 1976-04-13 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 (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-20080261950-A1 Compounds that inhibit cholinesterase ACHE, BCHE, CHAT LMNA 3474/4885CASP1 1818/4885KDM4E 1137/4885

“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.