SCHEMBL4237296

SCHEMBL4237296

CCCCN1CCC(Oc2ccc(C(=O)O)cc2OC)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.56
PDE4B Q07343 6/20 0.56
PDE4C Q08493 6/20 0.56
PDE4D Q08499 6/20 0.56
HTR4 Q13639 4/20 0.53
CHRM4 P08173 1/20 0.53
CHRM5 P08912 1/20 0.53
ADRA2C P18825 1/20 0.53
CHRM3 P20309 1/20 0.53
HTR1D P28221 1/20 0.53
ADRA1B P35368 1/20 0.53
HTR2B P41595 1/20 0.53
HTR3A P46098 1/20 0.53
TSHR P16473 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49

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
SCHEMBL4226863 0.87 HRH3 (0.47) PDE4APDE4BPDE4CPDE4DHTR4
SCHEMBL4237246 0.86 EPHX2 (0.51) HTR4CHRM4CHRM5ADRA2CCHRM3
SCHEMBL4232317 0.86 SSTR5 (0.46) PDE4APDE4BPDE4CPDE4DHTR4
SCHEMBL15574554 0.84 CA12 (0.58) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4233582 0.84 SLC6A5 (0.46) PDE4APDE4BPDE4CPDE4DHTR4
SCHEMBL16516951 0.81 CA12 (0.69) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4232026 0.81 SSTR5 (0.53)
SCHEMBL6799815 0.79 PDE4B (0.71) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL16544966 0.79 PDE4B (0.67) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4236276 0.79 HRH3 (0.48) SLC5A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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 (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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R PDE4A 491/4885PDE4B 461/4885PDE4C 451/4885

“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.