SCHEMBL5749355

SCHEMBL5749355

COc1ccccc1-c1cc2cnccc2nc1NC(=O)NC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
TP53 P04637 2/20 0.49
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
POLB P06746 1/20 0.45
MET P08581 1/20 0.45
PDGFRA P16234 2/20 0.44
KIT P10721 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 2/20 0.43
EPHX1 P07099 2/20 0.43
PDGFRB P09619 1/20 0.43
FGFR1 P11362 1/20 0.43
SRC P12931 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL5751077 0.87 PDGFRB (0.40) LMNATP53RAB9ANPC1PDGFRA
SCHEMBL5747258 0.84 FGFR1 (0.48) LMNATP53NPC1PDGFRAMAPT
SCHEMBL5751015 0.81 FGFR1 (0.63) PDGFRAPDGFRBFGFR1SRC
SCHEMBL5748530 0.81 ABL1 (0.53) PDGFRAPDGFRBFGFR1SRC
SCHEMBL5747448 0.81 NPC1 (0.45) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL5747463 0.81 EPHX1 (0.46) RAB9ANPC1POLBMAPTEPHX1
SCHEMBL5748571 0.80 NPC1 (0.51) LMNATP53RAB9ANPC1POLB
SCHEMBL5866816 0.80 PDGFRA (0.46) LMNARAB9ANPC1PDGFRAMEN1
SCHEMBL5749184 0.77 ALDH1A1 (0.51) LMNARAB9ANPC1POLBPDGFRA
SCHEMBL5748810 0.77 NPC1 (0.50) LMNARAB9ANPC1POLBMEN1

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
EP-1372648-B1 TIE2 RECEPTOR KINASE INHIBITORS FOR TREATING ANGIOGENIC DISEASES SMITHKLINE BEECHAM CORP (US) 2006-03-15 EP disclosed
US-7005434-B2 Compounds and uses thereof SB CORPORATION (US) 2006-02-28 US disclosed
US-20040048888-A1 Novel compounds and uses thereof SMITHKLINE BEECHAM CORPORATION 2004-03-11 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-20040048888-A1 Novel compounds and uses thereof TEK, TIE1, KDR LMNA 4279/4885TP53 1206/4885RAB9A 2298/4885

“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.