SCHEMBL13810669

SCHEMBL13810669

COc1ccc(Cc2cnc3ncc(-c4cnn(C)c4)cn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 5/20 0.48
▸ CHEK1 O14757 1/20 0.44
▸ CHEK2 O96017 1/20 0.44
▸ MET P08581 4/20 0.44
▸ MAPK8 P45983 1/20 0.43
▸ CSF1R P07333 7/20 0.41
▸ NTRK1 P04629 2/20 0.41
▸ NTRK3 Q16288 2/20 0.41
▸ NTRK2 Q16620 2/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ KIT P10721 1/20 0.39

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
SCHEMBL13810662 0.85 KDR (0.49) MET
SCHEMBL13810670 0.85 MET (0.48) CLK1CHEK1CHEK2MET
SCHEMBL1953680 0.83 MET (0.52) CLK1METKMT2A
SCHEMBL13810667 0.81 KDR (0.53) MET
SCHEMBL13810665 0.78 SMN1; SMN2 (0.48) METMEN1KMT2A
SCHEMBL1657795 0.74 MET (0.63) CLK1METCSF1R
SCHEMBL5990507 0.73 CLK1 (0.51) CLK1METMAPK8NTRK1NTRK2
SCHEMBL29074140 0.69 CSF1R (0.46) CLK1METMAPK8CSF1RNTRK1
SCHEMBL17754814 0.68 GRIN1 (0.63) METCSF1RNTRK1NTRK3NTRK2
SCHEMBL12821543 0.68 MET (0.57) METMAPK8CSF1RNTRK1NTRK3

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-20090156617-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2009-06-18 — — US disclosed
US-20090156617-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2009-06-18 — — 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-20090156617-A1 Tyrosine kinase inhibitors ABL1, ERBB2, MET CLK1 890/4885CHEK1 384/4885CHEK2 229/4885

“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.

Send feedback