SCHEMBL7659138

SCHEMBL7659138

COc1cccc(C2CCN(CCC(N)=O)CC2)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.69
NPSR1 Q6W5P4 1/20 0.55
NPY1R P25929 2/20 0.51
CHRM4 P08173 1/20 0.50
HTR2C P28335 2/20 0.49
SIGMAR1 Q99720 1/20 0.48
CCR2 P41597 1/20 0.48
CCR5 P51681 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
USP5 P45974 1/20 0.47
OPRM1 P35372 1/20 0.47
SLC18A3 Q16572 1/20 0.46
MCHR1 Q99705 1/20 0.46

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
SCHEMBL8479052 0.83 DRD2 (0.78) DRD2NPY1RHTR2CSIGMAR1
SCHEMBL20240320 0.83 DRD2 (0.78) DRD2NPY1RCHRM4HTR2CSIGMAR1
SCHEMBL29914653 0.82 DRD2 (1.00) DRD2HTR2CSIGMAR1
SCHEMBL21222765 0.82 DRD2 (1.00) DRD2HTR2CSIGMAR1
SCHEMBL7200383 0.81 DRD2 (0.66) DRD2CHRM4HTR2CCCR2CCR5
SCHEMBL7480157 0.81 DRD2 (0.74) DRD2NPY1RHTR2C
SCHEMBL14067226 0.80 DRD2 (0.72) DRD2CHRM4HTR2CCCR2CCR5
SCHEMBL4949320 0.80 DRD2 (0.64) DRD2NPY1RCHRM4HTR2CCCR2
Hydrochloric Acid SCHEMBL30206729 0.80 DRD2 (0.56) DRD2CHRM4HTR2CCCR2USP5
SCHEMBL7201323 0.80 DRD2 (0.60) DRD2NPY1RCHRM4HTR2CCCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6444675-B2 PROMOTING WEIGHT LOSS AND TREATING EATING DISORDERS BRISTOL-MYERS SQUIBB COMPANY 2002-09-03 US disclosed
US-20010049370-A1 4-Alkyl and 4-cycloalkyl derivatives of dihydropyridine NPY antagonists SIT SING-YUEN (US) 2001-12-06 US disclosed
WO-2001085690-A1 4-ALKYL AND 4-CYCLOALKYL DERIVATIVES OF DIHYDROPYRIDINE NPY ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-11-15 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-20010049370-A1 4-Alkyl and 4-cycloalkyl derivatives of dihydropyridine NPY antagonists NPY4R, NPY1R, NPY5R DRD2 164/4885NPSR1 34/4885NPY1R 2/4885

“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.