SCHEMBL4842841

SCHEMBL4842841

COC(=O)c1cc2ccccc2nc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.46
DHODH Q02127 4/20 0.45
MAPT P10636 2/20 0.44
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KDM4E B2RXH2 3/20 0.41
RUVBL1 Q9Y265 1/20 0.41
LTB4R Q15722 1/20 0.41
TOP1 P11387 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ALDH1A1 P00352 2/20 0.40
ACP1 P24666 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL27783089 0.86 SLC6A4 (0.54) DHODHMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL27992695 0.85 PDE10A (0.53) DHODHMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL22406080 0.78 KDM4E (0.46) KDM4EALDH1A1MEN1KMT2A
SCHEMBL398066 0.76 NTRK1 (0.52) CFTRDHODHMAPTKDM4EALDH1A1
SCHEMBL15665808 0.76 ALDH1A1 (0.56) DHODHMAPTKDM4EALDH1A1
SCHEMBL28480901 0.74 PPARA (0.49) SLC6A2SLC6A4SLC6A3KDM4ECNR1
SCHEMBL6637430 0.74 MAPT (0.50) CFTRMAPT
SCHEMBL4206899 0.74 TRPV1 (0.54) CFTR
SCHEMBL25149437 0.73 CFTR (0.47) CFTRDHODHMAPTKDM4EALDH1A1
SCHEMBL4849770 0.73 TRPV1 (0.44) CFTRDHODHKDM4ETOP1

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-7390907-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-06-24 US disclosed
US-20050153984-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2005-07-14 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-20050153984-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 CFTR 1816/4885DHODH 2323/4885MAPT 716/4885

“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.