SCHEMBL5203148

SCHEMBL5203148

Cc1cccc(/C(O)=C/c2ccnc(C)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.45
MAPK10 P53779 1/20 0.44
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
IDE P14735 2/20 0.37
KMO O15229 1/20 0.37
PARP1 P09874 1/20 0.37
F2 P00734 1/20 0.36
F12 P00748 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 1/20 0.36
NT5E P21589 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35

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
SCHEMBL5203158 1.00 GRM4 (0.45) GRM4MAPK10RAB9ANPC1LMNA
SCHEMBL5203641 0.79 MAPK10 (0.44) MAPK10RAB9ANPC1LMNASMN1; SMN2
SCHEMBL5203648 0.79 MAPK10 (0.44) MAPK10RAB9ANPC1LMNASMN1; SMN2
SCHEMBL5119907 0.79 PARP1 (0.41) MAPK10RAB9ANPC1LMNASMN1; SMN2
SCHEMBL5119910 0.79 PARP1 (0.41) MAPK10RAB9ANPC1LMNASMN1; SMN2
SCHEMBL5126085 0.74 AAK1 (0.38) GRM4MAPK10RAB9ANPC1LMNA
SCHEMBL12362127 0.71 MAPK10 (0.44) MAPK10RAB9ANPC1KMOPARP1
SCHEMBL2094602 0.69 PARP1 (0.52) MAPK10SMN1; SMN2PARP1TDP1HPGD
SCHEMBL12163925 0.69 PARP1 (0.52) MAPK10SMN1; SMN2PARP1TDP1HPGD
SCHEMBL311037 0.67 KDM4E (0.46) RAB9ANPC1SMN1; SMN2HTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199124-B2 JNK inhibitor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-03 US disclosed
US-20040063946-A1 Jnk inhibitor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1402900-A1 MEDICINAL COMPOSITIONS Takeda Chemical Industries, Ltd. (JP) 2004-03-31 EP disclosed
EP-1364949-A1 JNK INHIBITOR Takeda Chemical Industries, Ltd. (JP) 2003-11-26 EP 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-20040063946-A1 Jnk inhibitor MAPK1, MAPK7, MAP3K7 GRM4 3343/4885MAPK10 40/4885RAB9A 2829/4885

“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.