SCHEMBL4493295

SCHEMBL4493295

CC1(C)CN(Cc2ccsc2)CCN1C(=O)c1cc2cc[nH]c2cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.42
NR4A2 P43354 3/20 0.34
FFAR2 O15552 1/20 0.34
FAAH O00519 2/20 0.33
CPB2 Q96IY4 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33
LMNA P02545 2/20 0.32
ACHE P22303 1/20 0.32
HTR4 Q13639 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OPRL1 P41146 1/20 0.32

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
SCHEMBL4499882 0.84 MAPK14 (0.41) MAPK14NR4A2FFAR2PDE3BPDE3A
SCHEMBL4493302 0.75 MAPK14 (0.61) MAPK14NR4A2
SCHEMBL4513249 0.72 ALOX5 (0.32) CPB2LMNA
SCHEMBL14515756 0.69 MAPK14 (0.43) MAPK14NR4A2
SCHEMBL4513476 0.69 ALDH1A1 (0.41) CPB2ITGA4ITGB7LMNASIGMAR1
SCHEMBL4500424 0.66 CCR1 (0.51) MAPK14
SCHEMBL4500428 0.66 CCR1 (0.51) MAPK14
SCHEMBL4500150 0.64 MAPK14 (0.53) MAPK14
SCHEMBL4494742 0.64 MAPK14 (0.53) MAPK14FAAH
SCHEMBL4499825 0.63 MAPK14 (0.52) MAPK14LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488744-B2 Indole-type derivatives as inhibitors of p38 kinase SCIOS, INC. (US) 2009-02-10 US disclosed
US-20070232617-A1 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS, INC. (US) 2007-10-04 US disclosed
US-7220763-B2 Indole-type derivatives as inhibitors of p38 kinase SCIOS, INC. (US) 2007-05-22 US disclosed
EP-1545528-A4 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS INC (US) 2006-07-26 EP disclosed
EP-1545528-A2 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS INC. (US) 2005-06-29 EP disclosed
US-20040142940-A1 Indole-type derivatives as inhibitors of p38 kinase SCIOS, INC. 2004-07-22 US disclosed
WO-2004022712-A2 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF p38 KINASE SCIOS INC. (US) 2004-03-18 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-20040142940-A1 Indole-type derivatives as inhibitors of p38 kinase MAPK1, MAPKAPK2, MAPK4 MAPK14 28/4885NR4A2 2535/4885FFAR2 3497/4885
US-20070232617-A1 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE MAPK1, MAPKAPK2, MAPKAPK5 MAPK14 38/4885NR4A2 2370/4885FFAR2 3350/4885

“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.