SCHEMBL14959513

SCHEMBL14959513

CC(=O)c1ncc(C(F)(F)F)o1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.46
CES1 P23141 1/20 0.46
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
AGBL2 Q5U5Z8 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
ASPH Q12797 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
SCHEMBL10590680 0.82 FAAH (0.50) FAAHCES1KMT2AAGBL2MAPT
SCHEMBL11930611 0.81 FAAH (0.43) FAAHCES1LMNA
SCHEMBL11937006 0.79 FAAH (0.52) FAAHCES1AGBL2
SCHEMBL10121134 0.72
SCHEMBL14959509 0.68 MAPT (0.41) FAAHKMT2AALDH1A1NPSR1MAPT
SCHEMBL5985190 0.67 PDK2 (0.34) FAAHCES1NPSR1LMNA
SCHEMBL1706336 0.65 POLB (0.37) FAAHAGBL2RAB9A
SCHEMBL5237928 0.65 MEN1 (0.44) FAAHCES1KMT2AALDH1A1MEN1
SCHEMBL13561287 0.64 ACHE (0.38)
SCHEMBL14701723 0.64 TUBB4A (0.56) FAAHCES1KMT2AALDH1A1MEN1

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-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 US disclosed
US-8445527-B2 Organic compounds and their uses NOVARTIS AG (CH) 2013-05-21 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-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, HAVCR2, CPT1A FAAH 1183/4885CES1 113/4885KMT2A 3584/4885

“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.