SCHEMBL13603524

SCHEMBL13603524

CNC(=O)c1cc(Oc2ccc(CNC(=O)Nc3cc4ccccc4nc3OC)cc2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 2/20 0.53
CSF1R P07333 1/20 0.47
BRAF P15056 11/20 0.47
RAF1 P04049 6/20 0.46
MAPK14 Q16539 1/20 0.46
KDR P35968 3/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
EPHX2 P34913 1/20 0.44

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
SCHEMBL16990709 0.91 ALDH1A1 (0.46) DDR2CSF1RKDM4EMEN1ALDH1A1
SCHEMBL257963 0.88 RAF1 (0.59) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL13603476 0.85 DDR2 (0.57) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL15573077 0.84 DDR2 (0.65) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL4181174 0.83 RET (0.56) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL15574751 0.83 DDR2 (0.57) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL13603507 0.83 MAPK14 (0.51) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL15574195 0.83 DDR2 (0.63) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL13603508 0.81 BRAF (0.52) DDR2CSF1RBRAFRAF1MAPK14
SCHEMBL13603809 0.81 KDR (0.61) DDR2CSF1RBRAFRAF1MAPK14

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 14 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
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
EP-2888263-A1 HAPTENS OF RISPERIDONE AND PALIPERIDONE Janssen Pharmaceutica, N.V. (BE) 2015-07-01 EP disclosed
WO-2014032755-A2 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2014-03-06 WO disclosed
WO-2014031601-A1 HAPTENS OF RISPERIDONE AND PALIPERIDONE JANSSEN PHARMACEUTICA NV (BE) 2014-02-27 WO disclosed
US-20130158076-A1 Methylene Urea Derivatives MERCK PATENT GMBH (DE) 2013-06-20 US disclosed
US-8410143-B2 Methylene urea derivatives MERCK PATENT GMBH (DE) 2013-04-02 US disclosed
US-8410143-B2 Methylene urea derivatives MERCK PATENT GMBH (DE) 2013-04-02 US disclosed
US-20090298885-A1 METHYLENE UREA DERIVATIVES MERCK PATENT GMBH (DE) 2009-12-03 US disclosed
US-20090298885-A1 METHYLENE UREA DERIVATIVES MERCK PATENT GMBH (DE) 2009-12-03 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 (3 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-20090298885-A1 METHYLENE UREA DERIVATIVES BRAF, RAF1, CMPK1 DDR2 4558/4885CSF1R 2298/4885BRAF 1/4885
US-20150225369-A1 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS DDR2, DDR1, DDRGK1 DDR2 1/4885CSF1R 885/4885BRAF 3224/4885
US-20130158076-A1 Methylene Urea Derivatives BRAF, RAF1, CMPK1 DDR2 4558/4885CSF1R 2298/4885BRAF 1/4885

“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.