SCHEMBL16990643

SCHEMBL16990643

Cc1cc(OCCN2CCCC2)c(NC(=O)NCc2ccc(Oc3ccnc(C(=O)O)c3)cc2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 3/20 0.47
FLT1 P17948 4/20 0.47
FLT4 P35916 4/20 0.47
KDR P35968 4/20 0.47
HTR2A P28223 1/20 0.47
MAPK14 Q16539 2/20 0.42
MCHR1 Q99705 6/20 0.42
MCHR2 Q969V1 1/20 0.41
GSK3B P49841 1/20 0.41
P2RX3 P56373 2/20 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
SCHEMBL16990597 0.97 DDR2 (0.51) DDR2FLT1FLT4KDRHTR2A
SCHEMBL16990639 0.93 DDR2 (0.47) DDR2FLT1FLT4KDRHTR2A
SCHEMBL15575261 0.93 DDR2 (0.55) DDR2FLT1FLT4KDRHTR2A
SCHEMBL15574715 0.90 DDR2 (0.49) DDR2FLT1FLT4KDRHTR2A
SCHEMBL16990679 0.90 DDR2 (0.49) DDR2FLT1FLT4KDRHTR2A
SCHEMBL171401 0.90 DDR2 (0.55) DDR2FLT1FLT4KDRHTR2A
SCHEMBL15574596 0.90 DDR2 (0.60) DDR2FLT1FLT4KDRHTR2A
SCHEMBL15574776 0.87 GSK3B (0.54) DDR2FLT1FLT4KDRHTR2A
SCHEMBL16990600 0.87 DDR2 (0.51) DDR2GSK3BP2RX3
SCHEMBL16990629 0.87 DDR2 (0.50) DDR2GSK3BP2RX3

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 1 patent. 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 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 DDR2 1/4885FLT1 2139/4885FLT4 2680/4885

“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.