SCHEMBL2457546

SCHEMBL2457546

C(=C/c1n[nH]c2ccccc12)\c1ccon1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 14/20 0.41
KDR P35968 10/20 0.41
FGFR1 P11362 2/20 0.41
NTRK1 P04629 3/20 0.40
NTRK3 Q16288 3/20 0.40
NTRK2 Q16620 3/20 0.40
CDK4 P11802 3/20 0.40
PDPK1 O15530 2/20 0.40
TTK P33981 2/20 0.40
MAPK10 P53779 2/20 0.40
LCK P06239 2/20 0.40
BMPR1B O00238 1/20 0.40
PLK4 O00444 1/20 0.40
STK25 O00506 1/20 0.40
CIT O14578 1/20 0.40
RIOK3 O14730 1/20 0.40
IKBKB O14920 1/20 0.40
AURKA O14965 1/20 0.40
GAK O14976 1/20 0.40
DCLK1 O15075 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
SCHEMBL2457548 1.00 CHEK1 (0.41) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2455621 0.78 CHEK1 (0.40) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2455619 0.78 CHEK1 (0.40) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL30236917 0.76 CHEK1 (0.64) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL5250216 0.76 CHEK1 (0.64) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL29683745 0.76 CHEK1 (0.64) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2461823 0.75 CHEK1 (0.40) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2461824 0.75 CHEK1 (0.40) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2461234 0.74 CHEK1 (0.42) CHEK1KDRFGFR1NTRK1NTRK3
SCHEMBL2464030 0.74 KDR (0.49) CHEK1KDRFGFR1NTRK1NTRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110237633-A1 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-09-29 US disclosed
WO-2010068287-A2 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY ANGION BIOMEDICA CORP. (US) 2010-06-17 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-20110237633-A1 SMALL MOLECULE MODULATORS OF HEPATOCYTE GROWTH FACTOR (SCATTER FACTOR) ACTIVITY HGF, HDGF, MET CHEK1 2771/4885KDR 80/4885FGFR1 11/4885

“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.