SCHEMBL6231601

SCHEMBL6231601

CCCNc1cc(F)cc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 6/20 0.41
RAPGEF4 Q8WZA2 1/20 0.39
CYP1A2 P05177 2/20 0.36
IDO1 P14902 2/20 0.34
MAPK1 P28482 1/20 0.34
MERTK Q12866 1/20 0.34
THRB P10828 1/20 0.33
CHRNA7 P36544 1/20 0.33

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
SCHEMBL10625450 0.87 TRPA1 (0.49) TRPA1RAPGEF4CYP1A2THRB
SCHEMBL10345191 0.85 CA12 (0.46) TRPA1CYP1A2IDO1
SCHEMBL6233796 0.84 KCNH3 (0.47)
SCHEMBL3959091 0.82 RAPGEF4 (0.40) TRPA1RAPGEF4CYP1A2IDO1
SCHEMBL13736518 0.80 PGR (0.39) THRB
Hydrochloric Acid SCHEMBL13736778 0.80 IDO1 (0.37) TRPA1CYP1A2IDO1
SCHEMBL6235610 0.78 MAPT (0.50) TRPA1RAPGEF4CYP1A2IDO1
SCHEMBL30045340 0.77 IDO1 (0.36) RAPGEF4IDO1
SCHEMBL25650262 0.76 RAPGEF4 (0.41) TRPA1RAPGEF4CYP1A2MAPK1CHRNA7
Hydrochloric Acid SCHEMBL5857094 0.76 MAPT (0.48) TRPA1RAPGEF4CYP1A2IDO1

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-10472315-B2 Inhibitors of methionine aminopeptidases and methods of treating disorders THE JOHNS HOPKINS UNIVERSITY (US) 2019-11-12 US disclosed
EP-1530562-A1 OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME Central Glass Company, Limited (JP) 2005-05-18 EP disclosed
WO-2004022521-A1 OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME CENTRAL GLASS COMPANY, LIMITED (JP) 2004-03-18 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-10472315-B2 Inhibitors of methionine aminopeptidases and methods of treating disorders METAP1, METAP2, ENPEP TRPA1 4410/4885RAPGEF4 4734/4885CYP1A2 1045/4885

“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.