SCHEMBL4240622

SCHEMBL4240622

CCCCN1CCC(Oc2ccc(C(=O)O)cc2)C(F)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 4/20 0.47
HRH1 P35367 4/20 0.47
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
SLC6A5 Q9Y345 1/20 0.43
PLA2G4B P0C869 2/20 0.43
KDM1A O60341 1/20 0.43
RARB P10826 4/20 0.43
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
KCNH2 Q12809 1/20 0.40

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
SCHEMBL4237909 0.83 CHRM2 (0.52) HRH2HRH1HRH3
SCHEMBL4240823 0.81 HRH3 (0.57) HRH2HRH1HRH3
SCHEMBL4232026 0.81 SSTR5 (0.53) HRH2HRH1HRH3KCNH2
SCHEMBL20165868 0.74 ESR1 (0.61)
SCHEMBL20165122 0.74 ESR1 (0.61)
Hydrochloric Acid SCHEMBL29756830 0.73 ESR1 (0.60)
SCHEMBL4229151 0.71 SCN1A (0.47) HRH2HRH1TP53TSHRPLA2G4B
SCHEMBL4234134 0.70 MAOA (0.52) HRH2HRH1HRH3
SCHEMBL25933641 0.70 HRH3 (0.61) HRH1HRH3KCNH2
SCHEMBL19047979 0.69 HRH1 (0.67) HRH2HRH1KDM1AHRH3

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 HRH2 162/4885HRH1 217/4885TP53 4698/4885

“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.