SCHEMBL13167992

SCHEMBL13167992

O=C(CN1CC(c2cccc(C(F)(F)F)c2)N(c2ccc(Oc3ccc(Cl)cc3)cc2)C1=O)NCOCO

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
KMT2A Q03164 1/20 0.35
MCHR1 Q99705 1/20 0.35
MC4R P32245 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
CCR2 P41597 4/20 0.34
CCR1 P32246 1/20 0.34
CFTR P13569 1/20 0.34

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
SCHEMBL3586566 0.90 LMNA (0.41) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3581053 0.89 CETP (0.41) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3581216 0.88 CETP (0.40) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3592814 0.86 AHCY (0.39) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3591074 0.86 CETP (0.45) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3593502 0.85 LMNA (0.40) CETPLMNAMAPTHTTSMN1; SMN2
SCHEMBL3594261 0.84 CETP (0.47) CETPLMNAMAPTHTTMEN1
SCHEMBL3592772 0.82 CETP (0.43) CETPLMNAMAPTHTTMEN1
SCHEMBL3587291 0.82 CETP (0.43) CETPHTTSMN1; SMN2MEN1KMT2A
SCHEMBL3587298 0.82 CETP (0.43) CETPHTTSMN1; SMN2MEN1KMT2A

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-8431607-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2013-04-30 US disclosed
US-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2010-09-16 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-20100234365-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH CETP 779/4885LMNA 2549/4885MAPT 1780/4885

“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.