SCHEMBL2841931

SCHEMBL2841931

O=C(O)N1CCCC1C(O)c1nc2ccccc2s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.41
CYP3A4 P08684 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
ALOX5 P09917 1/20 0.40
HTR1A P08908 2/20 0.40
DRD2 P14416 2/20 0.40
HTR2A P28223 2/20 0.40
SLC6A4 P31645 2/20 0.40
HTR7 P34969 2/20 0.40
MAOB P27338 1/20 0.39
DPP4 P27487 2/20 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
SCHEMBL2841930 1.00 HPGD (0.46) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL4412431 0.84 L3MBTL1 (0.46) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL1598713 0.84 HPGD (0.42) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL2422679 0.79 HPGD (0.44) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL8938677 0.79 MEN1 (0.43) HPGDRAB9ANPC1MAPTKMT2A
SCHEMBL2837048 0.77 PKM (0.39) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL2836797 0.76 MEN1 (0.41) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL5177302 0.75 DPP4 (0.46) CYP1A2CYP2C9HSD17B10SMN1; SMN2CYP3A4
SCHEMBL3540440 0.75 DPP4 (0.46) CYP1A2CYP2C9HSD17B10SMN1; SMN2CYP3A4
SCHEMBL2422683 0.74 HPGD (0.42) HPGDCYP1A2CYP2C9CYP2C19HIF1A

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-7667044-B2 treating nervous system diorders such as Alzheimer's disease, Down Syndrome, Parkinson disease and Huntington chorea by administering inhibitors of prolyl endopeptidases PROBIODRUG AG (DE) 2010-02-23 US disclosed
EP-1824846-A2 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Probiodrug AG (DE) 2007-08-29 EP disclosed
WO-2006058720-A2 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PROBIODRUG AG (DE) 2006-06-08 WO disclosed
US-20060100253-A1 Novel compounds for the treatment of neurological disorders PROBIODRUG AG 2006-05-11 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-20060100253-A1 Novel compounds for the treatment of neurological disorders PREP, BACE1, BCHE HPGD 794/4885CYP1A2 3479/4885CYP2C9 3557/4885

“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.