SCHEMBL3745748

SCHEMBL3745748

CC1(C(F)(F)F)NC(=O)NC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
PYGM P11217 1/20 0.31
CACNA1F O60840 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
HTR2A P28223 1/20 0.30
HRH1 P35367 1/20 0.30
SCN1A P35498 1/20 0.30
SCN4A P35499 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
CACNA1D Q01668 1/20 0.30
KCNH2 Q12809 1/20 0.30
CACNA1S Q13698 1/20 0.30
CACNA1C Q13936 1/20 0.30
SCN5A Q14524 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN3A Q9NY46 1/20 0.30
MMP2 P08253 1/20 0.30

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
SCHEMBL6696060 0.78 LMNA (0.32) LMNACACNA1FALDH1A1MAPTCYP2C9
SCHEMBL11818576 0.70 LMNA (0.39) LMNAMMP2MMP9
SCHEMBL5197417 0.70 CYP2C9 (0.35) PYGMCACNA1FALDH1A1MAPTCYP2C9
SCHEMBL753785 0.64 ITGA4 (0.37) LMNACACNA1FALDH1A1MAPTCYP2C9
SCHEMBL21196916 0.64
SCHEMBL12803697 0.64 LMNA (0.36) LMNACACNA1FALDH1A1MAPTCYP2C9
SCHEMBL6278824 0.64 LMNA (0.36) LMNACACNA1FALDH1A1MAPTCYP2C9
SCHEMBL1363411 0.62
SCHEMBL20153077 0.62
SCHEMBL8225316 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100292321-A1 BIOFILM CONTROL ALBEMARLE CORPORATION (US) 2010-11-18 US disclosed
EP-2034837-A1 BIOFILM CONTROL Albermarle Corporation (US) 2009-03-18 EP disclosed
WO-2008003085-A1 BIOFILM CONTROL ALBEMARLE CORPORATION (US) 2008-01-03 WO 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-20100292321-A1 BIOFILM CONTROL CD47, MLEC, EPCAM LMNA 3240/4885PYGM 3547/4885CACNA1F 3813/4885

“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.