SCHEMBL2365744

SCHEMBL2365744

COC(=O)c1cccc(Oc2ccc(C(F)(F)F)cn2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.73
L3MBTL1 Q9Y468 3/20 0.61
MAPK1 P28482 2/20 0.61
GAA P10253 2/20 0.61
MAPT P10636 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
RAB9A P51151 1/20 0.56
FAAH O00519 5/20 0.53
LIPE Q05469 2/20 0.52
SCN9A Q15858 1/20 0.52
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NR1H2 P55055 1/20 0.51
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
MRGPRX4 Q96LA9 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MGLL Q99685 1/20 0.49

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
SCHEMBL2365689 0.86 MRGPRX4 (0.66) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL10436236 0.82 MAPK1 (0.63) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL2365700 0.81 L3MBTL1 (0.64) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL3640462 0.81 KDM4E (0.64) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL19032083 0.81 L3MBTL1 (0.57) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL22469765 0.81 MRGPRX4 (0.77) LMNAMRGPRX4
SCHEMBL30334648 0.81 MAPK1 (0.55) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL5552615 0.80 MAPT (0.62) L3MBTL1MAPK1GAAMAPTTDP1
SCHEMBL6531818 0.80 MAPK1 (0.75) LMNAL3MBTL1MAPK1GAAMAPT
SCHEMBL10515255 0.80 RAB9A (0.65) LMNAL3MBTL1MAPTTDP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927549-B2 Adamantyl benzamide derivatives HIGH POINT PHARMACEUTICALS, LLC (US) 2015-01-06 US disclosed
US-20110224244-A1 Adamantyl Benzamide Derivatives HIGH POINT PHARMACEUTICALS, LLC (US) 2011-09-15 US disclosed
EP-2362730-A1 ADAMANTYL BENZAMIDE COMPOUNDS High Point Pharmaceuticals, LLC (US) 2011-09-07 EP disclosed
WO-2010059618-A1 ADAMANTYL BENZAMIDE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-05-27 WO disclosed
EP-0348002-B1 Herbicidal acrylonitrile derivatives SHELL INT RESEARCH (NL) 1995-04-12 EP disclosed
US-4988385-A Plant growth regulators, antigrowth agents for plants SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1991-01-29 US disclosed
EP-0348002-A2 Herbicidal acrylonitrile derivatives SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-12-27 EP 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-20110224244-A1 Adamantyl Benzamide Derivatives HSD11B1, HSD17B11, HSD3B1 LMNA 2393/4885L3MBTL1 4221/4885MAPK1 2990/4885

“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.