SCHEMBL4240966

SCHEMBL4240966

COC(Cc1cc(C(=O)O)ccc1CNC1CCN(C)CC1)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.37
ADRB1 P08588 2/20 0.37
ADRB3 P13945 2/20 0.37
DRD4 P21917 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A5 Q9Y345 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM2B Q8NHM5 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
SSTR4 P31391 1/20 0.34
PDCD1LG2 Q9BQ51 1/20 0.34
CD274 Q9NZQ7 1/20 0.34

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
SCHEMBL27709142 0.80 BCHE (0.49) ADRB1ADRB3DRD4POLBKDM2B
SCHEMBL13841050 0.75 ALDH1A1 (0.44) CYP3A4MEN1KMT2AKDM4EALDH1A1
SCHEMBL5533747 0.73 DRD4 (0.50) DRD4MEN1KMT2AALDH1A1BCHE
SCHEMBL13841053 0.73 CYP3A4 (0.38) CYP3A4
SCHEMBL4214296 0.69 CHKA (0.50) DRD4MEN1KMT2AKDM4EALDH1A1
SCHEMBL21088503 0.69 HTT (0.50) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL4233674 0.68 HCAR3 (0.40)
SCHEMBL4687150 0.68 PTGER4 (0.43) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL16222287 0.66 CARM1 (0.56) CYP3A4CYP2D6SLC6A5MEN1KMT2A
SCHEMBL4733093 0.65 TSHR (0.57) MEN1POLBKMT2AKDM4EALDH1A1

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 1 patent. 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

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 ADRB2 96/4885ADRB1 97/4885ADRB3 141/4885

“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.