SCHEMBL2421874

SCHEMBL2421874

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2c(=O)n(CC3CC3)cc(CN3CCC(N4CCCCC4)CC3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 18/20 0.53
▸ SGK1 O00141 1/20 0.53
▸ MAPK13 O15264 1/20 0.47
▸ CYP2C9 P11712 2/20 0.45
▸ HSPB1 P04792 1/20 0.45
▸ MAPK11 Q15759 1/20 0.45
▸ KIT P10721 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ RIPK2 O43353 1/20 0.42
▸ RAF1 P04049 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL2420005 0.89 MAPK14 (0.55) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2419629 0.89 MAPK14 (0.56) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2417625 0.88 MAPK14 (0.54) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2425063 0.87 MAPK14 (0.53) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2419805 0.87 MAPK14 (0.53) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2420765 0.87 MAPK14 (0.53) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2416390 0.85 MAPK14 (0.51) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2415325 0.84 MAPK14 (0.62) MAPK14SGK1CYP2C9HSPB1MAPK11
SCHEMBL2420359 0.84 MAPK14 (0.53) MAPK14SGK1MAPK13CYP2C9HSPB1
SCHEMBL2420356 0.84 MAPK14 (0.53) MAPK14SGK1MAPK13CYP2C9HSPB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2144881-B1 ISOQUINOLINONE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF CHRONIC OBSTRUCTIVE PULMONARY DISEASE ( COPD ) AND ASTHMA ASTRAZENECA AB (SE) 2012-06-20 — — EP disclosed
EP-2144881-B1 ISOQUINOLINONE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF CHRONIC OBSTRUCTIVE PULMONARY DISEASE ( COPD ) AND ASTHMA ASTRAZENECA AB (SE) 2012-06-20 — — EP disclosed
US-8012979-B2 Compounds and their uses 707 ASTRAZENECA AB (SE) 2011-09-06 — — US disclosed
US-8012979-B2 Compounds and their uses 707 ASTRAZENECA AB (SE) 2011-09-06 — — US disclosed
US-8012979-B2 Compounds and their uses 707 ASTRAZENECA AB (SE) 2011-09-06 — — US disclosed
US-20090023746-A1 COMPOUNDS AND THEIR USES 707 ASTRAZENECA AB (SE) 2009-01-22 — — US disclosed
US-20090023746-A1 COMPOUNDS AND THEIR USES 707 ASTRAZENECA AB (SE) 2009-01-22 — — US disclosed
US-20090023746-A1 COMPOUNDS AND THEIR USES 707 ASTRAZENECA AB (SE) 2009-01-22 — — US disclosed
WO-2008122765-A1 NEW COMPOUNDS AND THEIR USES 707 ASTRAZENECA AB (SE) 2008-10-16 — — 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-20090023746-A1 COMPOUNDS AND THEIR USES 707 CYP3A7, UGT1A7, UGT2B7 MAPK14 4537/4885SGK1 2470/4885MAPK13 4623/4885

“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.

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