SCHEMBL13185877

SCHEMBL13185877

O=C1O[C@@H](CNCc2ccccc2)[C@H](c2cccc(F)c2)N1c1ccc(CF)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TNKS O95271 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
SCHEMBL4445907 0.89 PAX8 (0.35) GFERPOLBMEN1KMT2ATNKS
SCHEMBL3593660 0.89 PAX8 (0.35) GFERPOLBMEN1KMT2ATNKS
SCHEMBL3593757 0.77 KDM4E (0.39) POLBALDH1A1LMNA
SCHEMBL3585606 0.73 HTR1A (0.38) GFERPOLBMEN1KMT2AALDH1A1
SCHEMBL14161702 0.72 GFER (0.34) GFERMEN1KMT2A
SCHEMBL3587166 0.71 FADS1 (0.38) GFER
SCHEMBL3599584 0.71 MAPK14 (0.37) GFERMEN1KMT2ALMNA
SCHEMBL3595647 0.70 POLB (0.37) POLBKMT2A
SCHEMBL3586963 0.70 ALOX15 (0.41) GFERPOLBMEN1KMT2A
SCHEMBL15181621 0.70 RXFP1 (0.39) GFERPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 GFER 2722/4885POLB 4041/4885MEN1 2896/4885

“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.