SCHEMBL9974727

SCHEMBL9974727

COC(=O)c1cn(CC2CC2)c(=O)c2ccc(-c3cc(C(=O)NC4CC4)ccc3C)cc12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.60
SGK1 O00141 1/20 0.60
HSPB1 P04792 1/20 0.52
CYP2C9 P11712 1/20 0.52
MAPK11 Q15759 1/20 0.52
KIT P10721 2/20 0.48
RIPK2 O43353 2/20 0.47
KDR P35968 1/20 0.46

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
SCHEMBL2421496 0.91 MAPK14 (0.62) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL2418598 0.88 MAPK14 (0.58) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL2418236 0.88 MAPK14 (0.58) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL9974692 0.87 BRD4 (0.51) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL12284559 0.87 MAPK14 (0.57) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL2422741 0.86 MAPK14 (0.56) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL12284388 0.86 MAPK14 (0.50) MAPK14SGK1KITRIPK2KDR
SCHEMBL2418778 0.86 MAPK14 (0.56) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL2415325 0.86 MAPK14 (0.62) MAPK14SGK1HSPB1CYP2C9MAPK11
SCHEMBL2423691 0.85 MAPK14 (0.55) MAPK14SGK1HSPB1CYP2C9MAPK11

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-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-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 2470/4885HSPB1 3661/4885

“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.