SCHEMBL3274593

SCHEMBL3274593

O=C(C=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cc(Cl)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.54
MAPT P10636 5/20 0.54
KDM4E B2RXH2 4/20 0.54
NTRK1 P04629 1/20 0.52
CDK19 Q9BWU1 1/20 0.52
MEN1 O00255 7/20 0.50
KMT2A Q03164 7/20 0.50
P2RX1 P51575 3/20 0.50
P2RX4 Q99571 2/20 0.50
P2RX7 Q99572 2/20 0.50
TMPRSS4 Q9NRS4 2/20 0.50
IKBKB O14920 1/20 0.50
CHUK O15111 1/20 0.50
KDR P35968 1/20 0.50
FLT3 P36888 1/20 0.50
MYLK Q15746 1/20 0.50
MAP4K5 Q9Y4K4 1/20 0.50
ALDH1A1 P00352 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48

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
SCHEMBL3274588 1.00 CHRNA7 (0.54) CHRNA7MAPTKDM4ENTRK1CDK19
SCHEMBL10734737 0.80 MMP1 (0.72) MAPTKDM4EMMP1MMP2MMP9
SCHEMBL10734728 0.80 MMP1 (0.72) MAPTKDM4EMMP1MMP2MMP9
SCHEMBL28734377 0.78 KCNMA1 (0.63) CHRNA7NTRK1CDK19MEN1KMT2A
SCHEMBL29721833 0.78 KCNMA1 (0.63) CHRNA7NTRK1CDK19MEN1KMT2A
SCHEMBL11801204 0.76 MMP1 (0.59) MAPTMEN1KMT2AALDH1A1CYP1A2
SCHEMBL8061780 0.76 TRPA1 (0.70) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8061782 0.76 TRPA1 (0.70) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8063297 0.75 MEN1 (0.62) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8063301 0.75 MEN1 (0.62) MAPTKDM4EMEN1KMT2AALDH1A1

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-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 US claimed
US-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 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-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS TRPV1, TRPA1, TRPM8 CHRNA7 361/4885MAPT 1755/4885KDM4E 2144/4885

“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.