SCHEMBL15574401

SCHEMBL15574401

CNC(=O)c1cc(Oc2ccc(CNC(=O)Nc3cc(C(C)(C)C)on3)cc2)ccn1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 14/20 0.77
KDR P35968 1/20 0.77
RIPK2 O43353 1/20 0.54
DDR2 Q16832 2/20 0.51
MAPK13 O15264 2/20 0.50
MAPK14 Q16539 2/20 0.50
MAPK12 P53778 1/20 0.50
MAPK11 Q15759 1/20 0.50
CSF1R P07333 3/20 0.49
FLT3 P36888 3/20 0.49
EPHX2 P34913 1/20 0.49

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
SCHEMBL16990706 0.91 RAF1 (0.62) RAF1KDRRIPK2MAPK13MAPK14
SCHEMBL15574569 0.88 KDR (0.58) RAF1KDRRIPK2DDR2MAPK13
SCHEMBL13234850 0.87 RAF1 (1.00) RAF1KDRRIPK2DDR2MAPK13
SCHEMBL102637 0.85 RAF1 (0.72) RAF1KDRRIPK2MAPK13MAPK14
SCHEMBL3550019 0.85 RAF1 (0.71) RAF1KDRRIPK2MAPK13MAPK14
SCHEMBL14422914 0.83 RAF1 (0.82) RAF1KDRRIPK2DDR2MAPK13
SCHEMBL15574633 0.82 HDAC1 (0.60) RAF1KDRDDR2MAPK13MAPK14
SCHEMBL13603463 0.82 KDR (0.57) RAF1KDRDDR2MAPK13MAPK14
SCHEMBL13603634 0.81 RAF1 (0.58) RAF1KDRRIPK2DDR2MAPK13
SCHEMBL15574419 0.81 DDR2 (0.53) RAF1KDRRIPK2DDR2MAPK13

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-20150225369-A1 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2015-08-13 US claimed
EP-2890380-A2 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS Merck Patent GmbH (DE) 2015-07-08 EP claimed
WO-2014032755-A2 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2014-03-06 WO claimed
US-20150225369-A1 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2015-08-13 US disclosed
EP-2890380-A2 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS Merck Patent GmbH (DE) 2015-07-08 EP disclosed
WO-2014032755-A2 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2014-03-06 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-20150225369-A1 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS DDR2, DDR1, DDRGK1 RAF1 3072/4885KDR 404/4885RIPK2 472/4885

“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.