SCHEMBL171212

SCHEMBL171212

CNC(=O)c1cc(Oc2ccc(CNC(=O)Nc3cc(C)c(Cl)cc3OC)cc2C)ccn1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 4/20 0.83
RAF1 P04049 10/20 0.59
SMN1; SMN2 Q16637 1/20 0.45
CSF1R P07333 1/20 0.45
GSK3B P49841 1/20 0.44
NAMPT P43490 1/20 0.43
P2RX3 P56373 1/20 0.43
KDR P35968 2/20 0.42
MAPK14 Q16539 2/20 0.41
RIPK2 O43353 1/20 0.41
ABCB11 O95342 1/20 0.41
ABL1 P00519 1/20 0.41
NR3C1 P04150 1/20 0.41
RET P07949 1/20 0.41
HTR1A P08908 1/20 0.41
PDGFRB P09619 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
KIT P10721 1/20 0.41
CHRM1 P11229 1/20 0.41
BCR P11274 1/20 0.41

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
SCHEMBL171397 0.97 DDR2 (0.83) DDR2RAF1CSF1RGSK3BP2RX3
SCHEMBL17000078 0.93 DDR2 (0.82) DDR2RAF1CSF1RP2RX3KDR
SCHEMBL15574564 0.93 DDR2 (0.72) DDR2RAF1SMN1; SMN2CSF1RGSK3B
SCHEMBL15574694 0.92 DDR2 (0.70) DDR2RAF1SMN1; SMN2NAMPT
SCHEMBL13603633 0.92 DDR2 (0.70) DDR2RAF1CSF1RGSK3BKDR
SCHEMBL13603518 0.91 DDR2 (1.00) DDR2RAF1CSF1RP2RX3
SCHEMBL169159 0.90 DDR2 (0.71) DDR2RAF1CSF1RGSK3BKDR
SCHEMBL171330 0.90 DDR2 (0.71) DDR2RAF1CSF1RGSK3BKDR
SCHEMBL15573125 0.90 DDR2 (0.72) DDR2RAF1CSF1RGSK3BP2RX3
SCHEMBL15574418 0.90 DDR2 (0.72) DDR2RAF1CSF1RGSK3BP2RX3

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 13 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
US-20130158076-A1 Methylene Urea Derivatives MERCK PATENT GMBH (DE) 2013-06-20 US 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
EP-2426122-A1 Methylene urea derivative as RAF kinasse inhibitors Merck Patent GmbH (DE) 2012-03-07 EP 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 4558/4885RAF1 2/4885SMN1; SMN2 2976/4885
US-20150225369-A1 DDR2 INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS DDR2, DDR1, DDRGK1 DDR2 1/4885RAF1 3072/4885SMN1; SMN2 1789/4885
US-20130158076-A1 Methylene Urea Derivatives BRAF, RAF1, CMPK1 DDR2 4558/4885RAF1 2/4885SMN1; SMN2 2976/4885

“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.