SCHEMBL8213673

SCHEMBL8213673

CC(=O)N(C)c1cccc(C(=O)NCc2cnn(-c3cccc(C(F)(F)F)c3)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DDT P30046 2/20 0.51
ELANE P08246 3/20 0.44
EPHX2 P34913 1/20 0.43
CCR1 P32246 10/20 0.43
ADRB2 P07550 1/20 0.42
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
DHFR P00374 1/20 0.39
RECQL P46063 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
SCHEMBL12853556 0.91 DDT (0.49) DDTELANEEPHX2CCR1ADRB2
SCHEMBL3121773 0.89 DDT (0.47) DDTELANEEPHX2CCR1ADRB2
SCHEMBL12855298 0.86 DDT (0.49) DDTELANEEPHX2CCR1ADRB2
SCHEMBL12853538 0.84 DDT (0.52) DDTELANEEPHX2CCR1ADRB2
SCHEMBL8204104 0.84 DDT (0.54) DDTELANEEPHX2CCR1ADRB2
SCHEMBL8212310 0.83 DDT (0.53) DDTELANEEPHX2CCR1ADRB2
SCHEMBL8208208 0.83 DDT (0.53) DDTELANEEPHX2CCR1ADRB2
SCHEMBL12853297 0.83 DDT (0.53) DDTELANEEPHX2CCR1ADRB2
SCHEMBL12853550 0.81 DDT (0.51) DDTELANEEPHX2CCR1ADRB2
SCHEMBL12853541 0.80 DDT (0.50) DDTELANEEPHX2CCR1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2132178-B1 JNK INHIBITORS MERCK SHARP & DOHME (US) 2015-08-19 EP disclosed
US-8278337-B2 Substituted pyridines that are JNK inhibitors MERCK SHARP & DOHME (US) 2012-10-02 US disclosed
US-8278337-B2 Substituted pyridines that are JNK inhibitors MERCK SHARP & DOHME (US) 2012-10-02 US disclosed
US-20100179141-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-07-15 US disclosed
US-20100179141-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-07-15 US disclosed
WO-2008082487-A2 NOVEL JNK INHIBITORS SCHERING CORPORATION (US) 2008-07-10 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-20100179141-A1 NOVEL JNK INHIBITORS MAPK1, MAPKAPK5, MAPK15 DDT 4423/4885ELANE 1372/4885EPHX2 2332/4885

“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.