SCHEMBL15543404

SCHEMBL15543404

NC(CCC[O])C(=O)OC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
NAAA Q02083 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
EPHX1 P07099 2/20 0.35
CYP19A1 P11511 3/20 0.35
METAP1 P53582 1/20 0.34
CYP2C19 P33261 1/20 0.33
TYR P14679 1/20 0.33
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
TPSAB1 Q15661 3/20 0.32
TPSD1 Q9BZJ3 3/20 0.32
TPSG1 Q9NRR2 3/20 0.32
HTT P42858 1/20 0.32
DPP4 P27487 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP8 Q6V1X1 1/20 0.31

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
SCHEMBL15543405 0.86 MAPK13 (0.39) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL28614001 0.85 MAPK13 (0.40) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL2544784 0.85 GSR (0.47) MAPK13MAPK12MAPK11MAPK14TPSAB1
SCHEMBL30912985 0.85 GSR (0.43) MAPK13MAPK12MAPK11MAPK14L3MBTL1
SCHEMBL3344777 0.85 NAAA (0.39) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL30022635 0.83 NAAA (0.51) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL7782965 0.83 GSR (0.46) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL7782967 0.83 GSR (0.46) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL4027366 0.82 NAAA (0.39) MAPK13MAPK12MAPK11MAPK14NAAA
SCHEMBL4031737 0.82 NAAA (0.39) MAPK13MAPK12MAPK11MAPK14NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2864291-B1 N-[4-(QUINOLIN-4-YLOXY)CYCLOHEXYL(METHYL)](HETERO)ARYLCARBOXAMIDES AS ANDROGEN RECEPTOR ANTAGONISTS, PRODUCTION AND USE THEREOF AS MEDICINAL PRODUCTS Bayer Pharma AG (DE) 2016-10-05 EP disclosed
US-9428460-B2 N-[4-(quinolin-4-yloxy)cyclohexyl(methyl)](hetero)arylcarboxamides as androgen receptor antagonists, production and use thereof as medicinal products BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-08-30 US disclosed
US-20150191431-A1 N-[4-(Quinolin-4-yloxy)cyclohexyl(methyl)](hetero)arylcarboxamides as androgen receptor antagonists, production and use thereof as medicinal products BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-07-09 US disclosed
EP-2864291-A1 N-[4-(QUINOLIN-4-YLOXY)CYCLOHEXYL(METHYL)](HETERO)ARYLCARBOXAMIDES AS ANDROGEN RECEPTOR ANTAGONISTS, PRODUCTION AND USE THEREOF AS MEDICINAL PRODUCTS Bayer Pharma Aktiengesellschaft (DE) 2015-04-29 EP disclosed
WO-2014001247-A1 N-[4-(Quinolin-4-yloxy)cyclohexyl(methyl)](hetero)arylcarboxamides as androgen receptor antagonists, production and use thereof as medicinal products BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-01-03 WO 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-20150191431-A1 N-[4-(Quinolin-4-yloxy)cyclohexyl(methyl)](hetero)arylcarboxamides as androgen receptor antagonists, production and use thereof as medicinal products AR, NR5A1, CYP19A1 MAPK13 2441/4885MAPK12 1815/4885MAPK11 2457/4885

“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.