SCHEMBL849144

SCHEMBL849144

CCOC(=O)c1c(Cc2ccc(S(C)(=O)=O)cc2)c(=O)c2ccccc2n1C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 7/20 0.50
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPK9 P45984 5/20 0.46
MAPK10 P53779 3/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
PKM P14618 1/20 0.42
NPC1 O15118 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RORC P51449 1/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 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
SCHEMBL27800315 0.86 MAPK8 (0.52) MAPK8KDM4EALDH1A1MAPK9MAPK10
SCHEMBL848657 0.76 MAPK8 (0.75) MAPK8MAPK9MAPK10
SCHEMBL13620026 0.74 ALDH1A1 (0.46) MAPK8KDM4EALDH1A1MAPK9MAPK10
SCHEMBL1127428 0.73 ALDH1A1 (0.45) MAPK8KDM4EALDH1A1MAPK9MAPK10
SCHEMBL752911 0.73 ALDH1A1 (0.57) KDM4EALDH1A1PKMNPC1ALOX15
SCHEMBL7878088 0.71 TSHR (0.66) KDM4EALDH1A1PKMNPC1ALOX15
SCHEMBL30639225 0.71 TSHR (0.66) KDM4EALDH1A1PKMNPC1ALOX15
SCHEMBL9449427 0.71 KDM4E (0.56) KDM4EALDH1A1NPC1ALOX15TSHR
SCHEMBL9867870 0.70 ALDH1A1 (0.68) KDM4EALDH1A1PKMNPC1ALOX15
SCHEMBL23931478 0.69 ALDH1A1 (0.56) KDM4EALDH1A1PKMNPC1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163906-B2 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO, LLC (US) 2012-04-24 US disclosed
US-8163906-B2 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO, LLC (US) 2012-04-24 US disclosed
US-8163906-B2 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO, LLC (US) 2012-04-24 US disclosed
EP-2148862-B1 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK HOFFMANN LA ROCHE (CH) 2012-03-28 EP disclosed
EP-2148862-B1 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK HOFFMANN LA ROCHE (CH) 2012-03-28 EP disclosed
WO-2009015917-A2 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK F. HOFFMANN-LA ROCHE AG (CH) 2009-02-05 WO disclosed
WO-2008138920-A1 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK F. HOFFMANN-LA ROCHE AG (CH) 2008-11-20 WO disclosed
US-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO LLC 2008-11-20 US disclosed
US-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO LLC 2008-11-20 US disclosed
US-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK ROCHE PALO ALTO LLC 2008-11-20 US 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-20080287458-A1 Dihydroquinone and dihydronaphthridine inhibitors of JNK MAPK9, MAPK10, MAPK1 MAPK8 12/4885KDM4E 3326/4885ALDH1A1 3819/4885

“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.