SCHEMBL5010551

SCHEMBL5010551

Cn1nc(C(C)(C)C)cc1Nc1cc(-c2cncnc2)ccc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.45
BRAF P15056 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
MAPK13 O15264 2/20 0.41
MAPK11 Q15759 2/20 0.41
MAPT P10636 2/20 0.41
MAPK12 P53778 1/20 0.41
NTRK1 P04629 1/20 0.41
RET P07949 1/20 0.41
EPHB2 P29323 1/20 0.41
KDR P35968 1/20 0.41
CNR2 P34972 1/20 0.40
FTO Q9C0B1 1/20 0.40
LMNA P02545 2/20 0.40
AAK1 Q2M2I8 1/20 0.39
RAF1 P04049 1/20 0.39
ERBB2 P04626 1/20 0.39
XDH P47989 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
SCHEMBL5005285 0.89 MAPK14 (0.42) MAPK14BRAFMAPK13MAPK11MAPT
SCHEMBL5008530 0.79 MAPK14 (0.52) MAPK14KDM4EGRNSORT1MAPK13
SCHEMBL5008332 0.76 MAPK14 (0.48) MAPK14KDM4EGRNSORT1MAPK13
SCHEMBL5007763 0.75 MAPK14 (0.44) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL5008413 0.73 MAPK14 (0.47) MAPK14MAPK13MAPK11MAPTMAPK12
SCHEMBL5008343 0.72 MEN1 (0.50) MAPK14KDM4EGRNSORT1MAPK13
SCHEMBL5008749 0.72 MAPK14 (0.47) MAPK14KDM4EGRNSORT1MAPK13
SCHEMBL3974243 0.69 DHODH (0.50) MAPK14KDM4EGRNSORT1MAPK13
SCHEMBL11707284 0.69 CLCN2 (0.47) KDM4ESORT1MAPTFTO
SCHEMBL14600237 0.68 MAPK14 (0.55) MAPK14MAPK13MAPK11MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
US-20040157904-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION 2004-08-12 US disclosed
WO-2004050650-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2004-06-17 WO disclosed
WO-2004050651-A1 ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2004-06-17 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 (2 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-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 MAPK14 1938/4885BRAF 2016/4885KDM4E 3005/4885
US-20040157904-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 MAPK14 1938/4885BRAF 2016/4885KDM4E 3005/4885

“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.