SCHEMBL16990697

SCHEMBL16990697

CNCCOc1cc(Cl)c(C)cc1NC(=O)NCc1ccc(Oc2ccncc2)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 2/20 0.64
▸ RAF1 P04049 6/20 0.51
▸ CARM1 Q86X55 3/20 0.42
▸ PRMT6 Q96LA8 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HTT P42858 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NAMPT P43490 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
SCHEMBL15574181 0.89 DDR2 (0.80) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL169159 0.89 DDR2 (0.71) DDR2RAF1CARM1PRMT6
SCHEMBL15573229 0.89 DDR2 (0.52) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL16990677 0.88 DDR2 (0.74) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL16990737 0.87 DDR2 (0.73) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL16990592 0.87 DDR2 (0.68) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL15573113 0.87 DDR2 (0.61) DDR2RAF1SMN1; SMN2HTTALDH1A1
SCHEMBL16990594 0.86 DDR2 (0.60) DDR2RAF1CARM1PRMT6
SCHEMBL15574741 0.86 DDR2 (0.62) DDR2RAF1CARM1PRMT6SMN1; SMN2
SCHEMBL16990582 0.85 RAF1 (0.51) DDR2RAF1CARM1PRMT6SMN1; SMN2

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 1/4885RAF1 3072/4885CARM1 2530/4885

“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.

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