SCHEMBL4842780

SCHEMBL4842780

C=Cc1ccc(NC(=O)C(F)(F)F)c(C(=O)c2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
ABCC9 O60706 5/20 0.42
ABCC8 Q09428 5/20 0.42
KCNJ11 Q14654 5/20 0.42
KCNJ8 Q15842 5/20 0.42
ALDH1A1 P00352 2/20 0.41
MCL1 Q07820 1/20 0.41
LMNA P02545 1/20 0.41
PDK1 Q15118 3/20 0.41
PDK2 Q15119 3/20 0.41
PDK3 Q15120 3/20 0.41
PDK4 Q16654 3/20 0.41
MAPK1 P28482 1/20 0.41
TP53 P04637 1/20 0.40
HDAC2 Q92769 1/20 0.40
GAA P10253 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
SCHEMBL4847991 0.80 MAPT (0.70) MAPTALDH1A1LMNAMAPK1TP53
SCHEMBL6545922 0.80 MAPT (0.48) MAPTABCC9ABCC8KCNJ11KCNJ8
SCHEMBL29118239 0.79 ALDH1A1 (0.58) MAPTABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6545840 0.76 AKR1C4 (0.52) MAPTALDH1A1LMNAMAPK1GAA
SCHEMBL4847975 0.73 MAPT (0.58) MAPTALDH1A1LMNAMAPK1HDAC2
SCHEMBL5467266 0.73 AKR1C3 (0.56) ALDH1A1MCL1GAA
SCHEMBL3950779 0.70 GAA (0.45) MAPTALDH1A1MCL1LMNAMAPK1
SCHEMBL14311224 0.70 MEN1 (0.62) MAPTABCC9ABCC8KCNJ11KCNJ8
SCHEMBL3486870 0.70 MAPT (0.49) MAPTALDH1A1LMNAPDK1PDK2
SCHEMBL8755784 0.69 L3MBTL1 (0.59) MAPTALDH1A1LMNATP53HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326788-B2 Selective, potent small molecule protein tyrosine kinase inhibitors; such as 6-chloro-3-(3-methyl-isoxazol-5-yl)-4-(pyridin-4-yl)-1H-quinolin-2-one JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-05 US disclosed
US-7326788-B2 Selective, potent small molecule protein tyrosine kinase inhibitors; such as 6-chloro-3-(3-methyl-isoxazol-5-yl)-4-(pyridin-4-yl)-1H-quinolin-2-one JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-05 US disclosed
CN-1867334-A Quinolinone derivatives as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2006-11-22 CN disclosed
EP-1660087-A2 QUINOLINONE DERIVATIVES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP disclosed
US-20050049274-A1 Quinolinone derivatives as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-03 US disclosed
WO-2005009967-A2 QUINOLINONE DERIVATIVES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-03 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-20050049274-A1 Quinolinone derivatives as inhibitors of c-fms kinase FLT3, ABL1, FES MAPT 472/4885ABCC9 3241/4885ABCC8 1940/4885

“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.