SCHEMBL562409

SCHEMBL562409

O=C1CCCC(N(Cc2ccccc2)C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 3/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MTNR1A P48039 1/20 0.48
CTSD P07339 1/20 0.43
CHRM2 P08172 1/20 0.42
CHRM3 P20309 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
OPRM1 P35372 5/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGES O14684 1/20 0.41
MAPK1 P28482 1/20 0.40
CCR5 P51681 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL17352482 0.84 CTSD (0.50) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL13734228 0.83 YTHDC1 (0.46) AGERCYP3A4CYP2C9CYP2C19MTNR1A
SCHEMBL13734229 0.83 YTHDC1 (0.46) AGERCYP3A4CYP2C9CYP2C19MTNR1A
SCHEMBL28158343 0.82 CYP3A4 (0.45) AGERCYP3A4CYP2C9CYP2C19MTNR1A
SCHEMBL566741 0.81 AGER (0.49) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL2814615 0.81 AGER (0.67) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL5431901 0.81 AGER (0.55) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL5436734 0.81 AGER (0.55) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL3370759 0.79 AGER (0.55) AGERMTNR1ACTSDCHRM2CHRM3
SCHEMBL16320882 0.78 L3MBTL1 (0.39) CYP3A4CYP2C9CYP2C19L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822137-B2 Phosphonucleosides useful in the treatment of viral disorders UNIVERSITY COLLEGE CORK (IE) 2017-11-21 US disclosed
US-20150291640-A1 PHOSPHONUCLEOSIDES USEFUL IN THE TREATMENT OF VIRAL DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2015-10-15 US disclosed
US-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2012-02-09 US disclosed
US-8013003-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2011-09-06 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 (2 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-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES GRIN2A, GRIN2B, SLC18A2 AGER 1067/4885CYP3A4 3982/4885CYP2C9 4436/4885
US-20150291640-A1 PHOSPHONUCLEOSIDES USEFUL IN THE TREATMENT OF VIRAL DISORDERS ENTPD5, PNP, MTAP AGER 4684/4885CYP3A4 4261/4885CYP2C9 4810/4885

“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.