SCHEMBL4989286

SCHEMBL4989286

NC(=O)C[CH]c1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.52
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
PKM P14618 2/20 0.47
P4HB P07237 1/20 0.47
MEN1 O00255 1/20 0.47
HSP90AA1 P07900 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CES2 O00748 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAOB P27338 2/20 0.46
FBP1 P09467 1/20 0.45
ALDH1A1 P00352 2/20 0.44
HTT P42858 1/20 0.44
EPHX1 P07099 1/20 0.44
NFE2L2 Q16236 1/20 0.44
PLA2G10 O15496 1/20 0.44

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
SCHEMBL2399600 0.86 RECQL (0.51) RECQLLMNAMAPTPKMP4HB
SCHEMBL7381597 0.84 RPS6KA3 (0.50) RECQLLMNAMAPTCES2EPHX1
SCHEMBL4306491 0.84 P4HB (0.51) RECQLLMNAMAPTPKMP4HB
SCHEMBL13684398 0.80 HTT (0.49) RECQLLMNAMAPTPKMP4HB
SCHEMBL3167843 0.80 RECQL (0.57) RECQLLMNAMAPTPKMP4HB
SCHEMBL3171884 0.80 CYP1A2 (0.50) LMNAP4HBCES2ALDH1A1
SCHEMBL2675752 0.78 NFE2L2 (0.48) PKMCES2MAOBFBP1NFE2L2
SCHEMBL4321800 0.78 P4HB (0.48) RECQLLMNAMAPTPKMP4HB
SCHEMBL27796912 0.78 NFE2L2 (0.50) RECQLMAOBFBP1NFE2L2
SCHEMBL18577798 0.78 NFE2L2 (0.50) RECQLLMNAMAPTPKMP4HB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 US disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 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 (2 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-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 RECQL 1492/4885LMNA 857/4885MAPT 3215/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 RECQL 1492/4885LMNA 857/4885MAPT 3215/4885

“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.