SCHEMBL16990665

SCHEMBL16990665

COc1ccc(Cl)cc1NC(=O)NCc1ccc(Oc2ccnc(C(=O)O)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 2/20 0.69
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
RAF1 P04049 5/20 0.49
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
P2RX3 P56373 2/20 0.46
POLB P06746 1/20 0.46
CHEK1 O14757 1/20 0.46

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
SCHEMBL15573349 0.93 DDR2 (0.59) DDR2L3MBTL1ALDH1A1RAF1MAPT
SCHEMBL16990683 0.92 L3MBTL1 (0.62) DDR2L3MBTL1ALDH1A1RAF1MAPT
SCHEMBL15574169 0.91 DDR2 (0.82) DDR2L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL16990622 0.90 DDR2 (0.84) DDR2L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL15575329 0.90 KMT2A (0.60) DDR2L3MBTL1ALDH1A1RAF1TP53
SCHEMBL16990616 0.89 DDR2 (0.70) DDR2L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL15574618 0.89 DDR2 (0.55) DDR2L3MBTL1ALDH1A1RAF1TP53
SCHEMBL16990688 0.89 DDR2 (0.59) DDR2CYP1A2CYP2C19TP53MAPT
SCHEMBL16990591 0.88 DDR2 (0.63) DDR2L3MBTL1ALDH1A1CYP1A2CYP2C19
SCHEMBL16990693 0.88 HDAC1 (0.55) DDR2L3MBTL1ALDH1A1RAF1KMT2A

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 1/4885L3MBTL1 3554/4885ALDH1A1 2098/4885

“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.