SCHEMBL13745236

SCHEMBL13745236

Cc1c(C(N)=O)cc(-c2ccc(Cl)cc2Cl)n1CC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.48
HTR2A P28223 2/20 0.43
HTR2C P28335 2/20 0.43
SLC6A4 P31645 2/20 0.43
CHRNA7 P36544 1/20 0.40
OPRL1 P41146 1/20 0.40
CNR2 P34972 3/20 0.40
ACHE P22303 1/20 0.39
HTR4 Q13639 1/20 0.39
PLA2G2A P14555 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RORC P51449 1/20 0.39
NOTUM Q6P988 1/20 0.38
METAP2 P50579 1/20 0.37

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
SCHEMBL13745396 0.91 CNR1 (0.54) CNR1HTR2AHTR2CSLC6A4OPRL1
SCHEMBL3928179 0.90 NOTUM (0.50) CNR1HTR2AHTR2CSLC6A4CHRNA7
SCHEMBL3922294 0.85 CNR1 (0.56) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL13602551 0.85 HTR2A (0.49) CNR1HTR2AHTR2CSLC6A4CHRNA7
SCHEMBL3920985 0.84 CNR1 (0.50) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL6464405 0.82 CNR1 (0.71) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL13602554 0.82 CNR1 (0.71) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL13717141 0.82 CNR1 (0.71) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL13717376 0.82 CNR1 (0.71) CNR1HTR2AHTR2CSLC6A4CNR2
SCHEMBL13717726 0.82 CNR1 (0.71) CNR1HTR2AHTR2CSLC6A4CNR2

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-7579369-B2 CB 1 receptor inverse agonists HOFFMANN-LA ROCHE INC. (US) 2009-08-25 US disclosed
US-20070238754-A1 Novel CB 1 receptor inverse agonists MAYWEG ALEXANDER 2007-10-11 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-20070238754-A1 Novel CB 1 receptor inverse agonists CNR1, CNR2, GPR139 CNR1 1/4885HTR2A 255/4885HTR2C 240/4885

“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.