SCHEMBL10130191

SCHEMBL10130191

Cc1ccc(Cl)cc1-c1cccc(C(=O)Nc2ccc(OCCN3CCOCC3)c3ccccc23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.60
DDR2 Q16832 2/20 0.57
KDR P35968 5/20 0.56
MAPK13 O15264 4/20 0.53
MAPK12 P53778 4/20 0.53
MAPK11 Q15759 4/20 0.53
TNF P01375 2/20 0.48
HTR2A P28223 2/20 0.48
HTR2C P28335 1/20 0.48
CIT O14578 1/20 0.48
MUSK O15146 1/20 0.48
MAP3K7 O43318 1/20 0.48
RIPK2 O43353 1/20 0.48
STK10 O94804 1/20 0.48
MAP4K4 O95819 1/20 0.48
CHEK2 O96017 1/20 0.48
ABL1 P00519 1/20 0.48
EGFR P00533 1/20 0.48
RAF1 P04049 1/20 0.48
NTRK1 P04629 1/20 0.48

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
SCHEMBL10130451 0.94 MAPK14 (0.60) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10158738 0.92 MAPK14 (0.60) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL594549 0.92 MAPK14 (0.59) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130458 0.92 MAPK14 (0.59) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10157736 0.92 MAPK14 (0.59) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130443 0.91 DDR2 (0.64) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130115 0.91 MAPK14 (0.59) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130205 0.90 MAPK14 (0.61) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130477 0.90 MAPK14 (0.61) MAPK14DDR2KDRMAPK13MAPK12
SCHEMBL10130114 0.89 MAPK14 (0.64) MAPK14DDR2KDRMAPK13MAPK12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114873-B2 1,4-disubstituted naphthalenes as inhibitors of p38 map kinase ARQULE, INC. (US) 2012-02-14 US disclosed
US-20100311754-A1 1,4-Disubstituted Naphthalenes as Inhibitors of P38 Map Kinase ARQULE, INC. (US) 2010-12-09 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-20100311754-A1 1,4-Disubstituted Naphthalenes as Inhibitors of P38 Map Kinase MAPK1, MAPK7, MAP3K1 MAPK14 15/4885DDR2 3028/4885KDR 4065/4885

“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.