SCHEMBL3273773

SCHEMBL3273773

O=C(C=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(-c2ccc(Cl)cc2)cc1-c1nn[nH]n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 1/20 0.46
LTB4R Q15722 1/20 0.45
PYGL P06737 1/20 0.45
KDM1A O60341 3/20 0.44
GPR35 Q9HC97 3/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
TRPM2 O94759 1/20 0.40
XDH P47989 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL3273771 1.00 KCNMA1 (0.46) KCNMA1LTB4RPYGLKDM1AGPR35
SCHEMBL3277357 0.84 TRPM2 (0.40) TRPM2KDM4EMEN1CYP1A2CYP2D6
SCHEMBL3277364 0.84 TRPM2 (0.40) TRPM2KDM4EMEN1CYP1A2CYP2D6
SCHEMBL4557459 0.79 KDM1A (0.50) PYGLKDM1AGPR35XDHALDH1A1
SCHEMBL3273276 0.77 GPR35 (0.59) KCNMA1GPR35KDM4EMEN1KMT2A
SCHEMBL3273270 0.77 GPR35 (0.59) KCNMA1GPR35KDM4EMEN1KMT2A
SCHEMBL3274593 0.70 CHRNA7 (0.54) KDM4EMEN1CYP1A2CYP2D6CYP2C19
SCHEMBL3274588 0.70 CHRNA7 (0.54) KDM4EMEN1CYP1A2CYP2D6CYP2C19
SCHEMBL2892700 0.68 GPR35 (0.71) KCNMA1GPR35
SCHEMBL3274304 0.68 KDM4E (0.40) TRPM2KDM4EMEN1CYP1A2CYP2D6

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 KCNMA1 103/4885LTB4R 2132/4885PYGL 4867/4885

“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.