SCHEMBL1753370

SCHEMBL1753370

COc1ncccc1C(=O)NC1CCNC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.49
CNR1 P21554 5/20 0.49
DGAT2 Q96PD7 2/20 0.48
PBK Q96KB5 5/20 0.48
DRD4 P21917 1/20 0.46
PARP1 P09874 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
RAB9A P51151 1/20 0.44
MAPK1 P28482 1/20 0.44
OPRK1 P41145 1/20 0.44

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
SCHEMBL10107496 0.93 CNR2 (0.54) CNR2CNR1DGAT2MEN1KMT2A
SCHEMBL1753334 0.88 CNR2 (0.55) CNR2CNR1MEN1KMT2ARAB9A
SCHEMBL23201613 0.83 DGAT2 (0.51) CNR2CNR1DGAT2PBKMEN1
SCHEMBL1753490 0.80 DRD4 (0.55) DRD4MEN1KMT2ARAB9AMAPK1
SCHEMBL10107630 0.80 CNR2 (0.51) CNR2CNR1DGAT2RAB9A
SCHEMBL11814700 0.78 CHRM1 (0.53) CNR2CNR1MEN1KMT2A
SCHEMBL30843806 0.77 CHRM1 (0.53)
SCHEMBL29280924 0.77 CHRM1 (0.53)
SCHEMBL14477851 0.76 PARP1 (0.46) DGAT2PBKDRD4PARP1MAPK1
SCHEMBL14477850 0.76 PARP1 (0.46) DGAT2PBKDRD4PARP1MAPK1

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 CNR2 2151/4885CNR1 2051/4885DGAT2 79/4885

“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.