SCHEMBL7119094

SCHEMBL7119094

CC(C)Cc1c(CC(F)(F)F)c2cc(Cl)ccc2[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
ROCK2 O75116 1/20 0.40
MAP4K4 O95819 1/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40
PIM1 P11309 1/20 0.40
RPS6KB1 P23443 1/20 0.40
CDK2 P24941 1/20 0.40
MAPK1 P28482 1/20 0.40
EPHA2 P29317 1/20 0.40
FLT3 P36888 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
SCHEMBL7552688 0.93 ALDH1A1 (0.51) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL7120211 0.79 ALDH1A1 (0.62) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL23259127 0.74 HTR7 (0.60) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL7118690 0.71 MEN1 (0.40) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL7717333 0.68 KDM4E (0.42) MEN1KMT2AMAPTGAAKDM4E
SCHEMBL7116100 0.68 SIRT1 (0.45) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL7114815 0.66 ALDH1A1 (0.67) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL6991966 0.66 MEN1 (0.52) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL7124017 0.66 KDM4E (0.46) MEN1ALDH1A1KMT2AMAPTGSK3B
SCHEMBL7124929 0.66 SIRT1 (0.46) MEN1ALDH1A1KMT2AMAPTLMNA

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-20030069271-A1 Quinolone compounds for use in treating viral infections SMITHKLINE BEECHAM CORPORATION 2003-04-10 US disclosed
EP-1244629-A2 QUINOLONE COMPOUNDS FOR USE IN TREATING VIRAL INFECTIONS GLAXO GROUP LIMITED (GB) 2002-10-02 EP disclosed
WO-2001046150-A2 QUINOLONE COMPOUNDS FOR USE IN TREATING VIRAL INFECTIONS GLAXO GROUP LIMITED (GB) 2001-06-28 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-20030069271-A1 Quinolone compounds for use in treating viral infections IRF3, MAVS, NQO2 MEN1 3110/4885ALDH1A1 1742/4885KMT2A 2982/4885

“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.