SCHEMBL1753367

SCHEMBL1753367

COc1ncccc1C(=O)NC1CCN(Cc2ccccc2)C1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 14/20 0.64
DRD2 P14416 6/20 0.64
MCHR1 Q99705 1/20 0.62
DRD3 P35462 5/20 0.60
SIGMAR1 Q99720 2/20 0.60
SLC6A12 P48065 1/20 0.58
POLB P06746 1/20 0.57
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55

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
SCHEMBL10107494 0.94 SLC6A12 (0.66) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL14205010 0.84 POLB (0.58) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL1753725 0.84 DRD4 (0.77) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL8706525 0.79 CCR3 (0.73) DRD4DRD2SIGMAR1POLB
SCHEMBL14205981 0.79 POLB (0.65) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL2900272 0.78 SIGMAR1 (0.86) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL1753373 0.78 DRD4 (0.51) DRD4DRD2DRD3SIGMAR1
SCHEMBL10107601 0.77 SLC6A12 (0.83) DRD4DRD2MCHR1DRD3SIGMAR1
SCHEMBL8711818 0.76 DRD4 (0.71) DRD4DRD2SIGMAR1POLB
SCHEMBL7694198 0.76 DRD2 (0.85) DRD4DRD2MCHR1SIGMAR1SLC6A12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158783-B2 MTP inhibiting tetrahydro-naphthalene-1-carboxylic acid derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
US-8158783-B2 MTP inhibiting tetrahydro-naphthalene-1-carboxylic acid derivatives JANSSEN PHARMACEUTICA N.V. (BE) 2012-04-17 US disclosed
US-20100016291-A1 MTP INHIBITING TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2010-01-21 US disclosed
US-20100016291-A1 MTP INHIBITING TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2010-01-21 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-20100016291-A1 MTP INHIBITING TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID DERIVATIVES PNLIP, APOB, MTPN DRD4 4420/4885DRD2 4546/4885MCHR1 3082/4885

“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.