SCHEMBL4297282

SCHEMBL4297282

COc1ccccc1C(=O)NC1CCc2ccccc2C1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
PIN1 Q13526 1/20 0.52
TAS1R3 Q7RTX0 2/20 0.52
TAS1R1 Q7RTX1 2/20 0.52
ALDH1A1 P00352 1/20 0.52
TDP1 Q9NUW8 1/20 0.49
OPRM1 P35372 1/20 0.49
TRPV1 Q8NER1 3/20 0.48
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
NPY5R Q15761 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK14 Q16539 1/20 0.46
HCRTR1 O43613 1/20 0.45

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
Bromide SCHEMBL1593622 0.99 MEN1 (0.57) MEN1KMT2APIN1TAS1R3TAS1R1
SCHEMBL1594645 0.85 PIN1 (0.50) MEN1KMT2APIN1TAS1R3TAS1R1
SCHEMBL23772363 0.81 TRPV1 (0.55) TRPV1NPY5R
SCHEMBL9854680 0.81 TRPV1 (0.55) TRPV1NPY5R
SCHEMBL9490339 0.80 TRPV1 (0.57) TRPV1NPY5R
SCHEMBL9854669 0.78 TRPV1 (0.53) MEN1KMT2ATRPV1NPY5RCYP2C19
SCHEMBL1594785 0.77 NPY5R (0.53) MEN1KMT2ANPY5R
SCHEMBL1594787 0.77 NPY5R (0.53) MEN1KMT2ANPY5R
SCHEMBL1594786 0.77 NPY5R (0.53) MEN1KMT2ANPY5R
Bromide SCHEMBL1593620 0.76 NPY5R (0.52) MEN1KMT2ANPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8217001-B2 Modification of feeding behavior IMPERIAL INNOVATIONS LIMITED 2012-07-10 US disclosed
US-20090209461-A1 MODIFICATION OF FEEDING BEHAVIOR IMPERIAL COLLEGE INNOVATIONS LTD. (GB) 2009-08-20 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-20090209461-A1 MODIFICATION OF FEEDING BEHAVIOR NPY4R, NPY5R, NPY2R MEN1 1419/4885KMT2A 1557/4885PIN1 4442/4885

“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.