SCHEMBL16990723

SCHEMBL16990723

Cc1cc(CNC(=O)Nc2cccc(S(C)(=O)=O)c2)ccc1Oc1ccnc(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 2/20 0.51
NAMPT P43490 6/20 0.43
KCNQ3 O43525 2/20 0.42
KCNQ2 O43526 2/20 0.42
MAPK1 P28482 2/20 0.42
KDR P35968 3/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
BRAF P15056 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 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
SCHEMBL171046 0.92 DDR2 (0.62) DDR2NAMPTKCNQ3KCNQ2MAPK1
SCHEMBL16990615 0.90 DDR2 (0.51) DDR2NAMPTMAPK1KDRNPC1
SCHEMBL15574271 0.89 NAMPT (0.48) NAMPTKDRNPC1RAB9ASMN1; SMN2
SCHEMBL13603587 0.82 DDR2 (0.59) DDR2MAPK1KDRBRAFSMN1; SMN2
SCHEMBL15574415 0.82 DDR2 (0.62) DDR2MAPK1KDRBRAFMEN1
SCHEMBL15573040 0.80 KDR (0.56) DDR2MAPK1KDRBRAFMEN1
SCHEMBL16990729 0.80 CA2 (0.52) NAMPTKDRMEN1KMT2A
SCHEMBL15573117 0.79 DDR2 (0.56) DDR2NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16990593 0.79 DDR2 (0.58) DDR2MEN1KMT2A
SCHEMBL16990725 0.79 DDR2 (0.56) DDR2MAPK1MEN1KMT2A

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 1/4885NAMPT 2021/4885KCNQ3 4654/4885

“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.