SCHEMBL5096264

SCHEMBL5096264

CCOC(=O)C1CCC(Nc2nccc(-n3ncc4ccccc43)n2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 18/20 0.67
MAPK9 P45984 18/20 0.67
MAPK10 P53779 17/20 0.67
CDK2 P24941 3/20 0.50
CCNE1 P24864 2/20 0.50
CYP2C9 P11712 1/20 0.50
GSK3B P49841 2/20 0.47
MAPK14 Q16539 2/20 0.47
JUN P05412 1/20 0.47

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
SCHEMBL5096260 1.00 MAPK8 (0.67) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5090282 0.85 MAPK8 (0.77) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL3809101 0.85 MAPK8 (0.77) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5093797 0.84 MAPK8 (0.66) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL8201467 0.84 MAPK8 (0.71) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL3810122 0.84 MAPK8 (0.71) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5102470 0.84 MAPK8 (0.71) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5090618 0.82 MAPK8 (0.68) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5093787 0.82 MAPK8 (0.68) MAPK8MAPK9MAPK10CDK2CCNE1
SCHEMBL5102745 0.82 MAPK8 (0.63) MAPK8MAPK9MAPK10CDK2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399462-B2 4-[4-(4-benzyloxy-indol-1-yl)-pyrimidin-2-ylamino]-cyclohexanol; autoimmune, inflammatory, metabolic, neurological diseases as well as cancer and pain ROCHE PALO ALTO LLC (US) 2013-03-19 US disclosed
US-20080146565-A1 JNK modulators ROCHE PALO ALTO LLC 2008-06-19 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-20080146565-A1 JNK modulators MAPKAPK2, MAPKAPK3, MAP3K10 MAPK8 40/4885MAPK9 43/4885MAPK10 31/4885

“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.