SCHEMBL8208043

SCHEMBL8208043

Cc1ccc(CNC(=O)c2cccc(C(=O)NC(C)C)n2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 5/20 0.49
HPGD P15428 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
POLB P06746 1/20 0.43
MMP10 P09238 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NOD2 Q9HC29 1/20 0.42
TP53 P04637 1/20 0.41
HTT P42858 2/20 0.41
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41

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
SCHEMBL29333050 0.83 SMN1; SMN2 (0.51) MMP13HPGDALDH1A1SMN1; SMN2CA1
SCHEMBL8208507 0.80 KMT2A (0.65) ALDH1A1SMN1; SMN2MEN1KMT2ANOD2
SCHEMBL8198970 0.80 ROCK2 (0.48) MMP13HPGDALDH1A1SMN1; SMN2ROCK2
SCHEMBL8205783 0.80 MEN1 (0.52) HPGDALDH1A1ROCK2ROCK1POLB
SCHEMBL12853358 0.80 HPGD (0.53) MMP13HPGDALDH1A1SMN1; SMN2ROCK2
SCHEMBL8198502 0.79 SMN1; SMN2 (0.53) HPGDALDH1A1SMN1; SMN2CA1CA2
SCHEMBL8209272 0.79 ROCK2 (0.53) MMP13HPGDALDH1A1SMN1; SMN2ROCK2
SCHEMBL8200906 0.78 HPGD (0.54) MMP13HPGDALDH1A1SMN1; SMN2ROCK2
SCHEMBL8213321 0.78 ALDH1A1 (0.41) MMP13HPGDALDH1A1SMN1; SMN2ROCK2
SCHEMBL8199927 0.78 CNR2 (0.50) SMN1; SMN2POLB

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 MMP13 2969/4885HPGD 2369/4885ALDH1A1 3650/4885

“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.