SCHEMBL2862956

SCHEMBL2862956

COc1ccc(-c2ccc(Cc3ccccc3)nn2)cc1F

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.69
KDR P35968 1/20 0.69
MST1R Q04912 1/20 0.69
CYP17A1 P05093 1/20 0.50
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MGLL Q99685 1/20 0.44
FYN P06241 1/20 0.43
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
ERN1 O75460 1/20 0.42
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL2862746 0.83 MET (1.00) METKDRMST1R
SCHEMBL15405350 0.81 MET (0.75) METKDRMST1RCYP17A1ALDH1A1
SCHEMBL2859702 0.80 MET (0.50) METKDRMST1RCYP17A1ALDH1A1
SCHEMBL2858796 0.75 PTGES (0.52) METKDRMST1RCYP17A1ALDH1A1
SCHEMBL1742298 0.74 ALDH1A1 (0.51) METKDRMST1RCYP17A1ALDH1A1
SCHEMBL8481713 0.70 CYP17A1 (0.57) CYP17A1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL28328291 0.70 ALDH1A1 (0.59) METKDRMST1RALDH1A1SMN1; SMN2
SCHEMBL3995066 0.70 ALDH1A1 (0.60) CYP17A1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL9815139 0.69 ALDH1A1 (0.58) CYP17A1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL9464193 0.68 CYP17A1 (0.61) CYP17A1ALDH1A1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1827434-B1 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER AMGEN INC (US) 2014-01-15 EP disclosed
US-7652009-B2 Substituted heterocycles and methods of use AMGEM INC. (US) 2010-01-26 US disclosed
EP-1827434-A2 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER Amgen Inc. (US) 2007-09-05 EP disclosed
US-20060252777-A1 Substituted heterocycles and methods of use AMGEN INC. (US) 2006-11-09 US disclosed
WO-2006060318-A2 QUINOLINES AND QUINAZOLINE ANALOGS AND THEIR USE AS MEDICAMENTS FOR TREATING CANCER AMGEN INC. (US) 2006-06-08 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-20060252777-A1 Substituted heterocycles and methods of use HGF, HGFAC, MET MET 3/4885KDR 231/4885MST1R 815/4885

“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.