SCHEMBL17138115

SCHEMBL17138115

CC1(C)C(=O)N(C2CC2)c2nc(Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MARK3 P27448 10/20 0.47
MARK4 Q96L34 6/20 0.46
CDK2 P24941 2/20 0.43
CCNE1 P24864 1/20 0.43
HTR2A P28223 3/20 0.35
HTR2C P28335 3/20 0.35
HTR2B P41595 3/20 0.35
KCNH2 Q12809 1/20 0.35
NUAK1 O60285 2/20 0.34
SIK1 P57059 1/20 0.34
NUAK2 Q9H093 1/20 0.34
SIK2 Q9H0K1 1/20 0.34
SIK3 Q9Y2K2 1/20 0.34
SGK1 O00141 1/20 0.33
PIK3CD O00329 1/20 0.33
CHEK1 O14757 1/20 0.33
IKBKB O14920 1/20 0.33
MAPK13 O15264 1/20 0.33
CCNT1 O60563 1/20 0.33
JAK2 O60674 1/20 0.33

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
Hydrochloric Acid SCHEMBL15578951 0.84 MARK3 (0.46) MARK3MARK4CDK2CCNE1NUAK1
SCHEMBL18824444 0.77 MARK3 (0.39) MARK3MARK4CDK2CCNE1
SCHEMBL6073476 0.76 LCK (0.38) MARK3HTR2AHTR2CHTR2BKCNH2
SCHEMBL28767333 0.73 MARK3 (0.50) MARK3MARK4CDK2CCNE1NUAK1
SCHEMBL15578846 0.71 MARK3 (0.43) MARK3MARK4CDK2CCNE1MAPK1
SCHEMBL16322702 0.70 MARK3 (0.36) MARK3MARK4CDK2CCNE1
SCHEMBL15578995 0.70 MARK3 (0.41) MARK3MARK4CDK2CCNE1NUAK1
SCHEMBL18850750 0.69 MARK3 (0.40) MARK3MARK4CDK2CCNE1MAPK1
SCHEMBL16321780 0.67 MARK3 (0.47) MARK3MARK4CDK2CCNE1NUAK1
SCHEMBL15210247 0.67 MARK3 (0.46) MARK3MARK4CDK2CCNE1HTR2A

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
EP-2895476-B1 2-OXO-2,3-DIHYDRO-INDOLES FOR THE TREATMENT OF CNS DISORDERS HOFFMANN LA ROCHE (CH) 2016-06-22 EP disclosed
US-9221816-B2 2-oxo-2,3-dihydro-indoles for the treatment of CNS disorders HOFFMANN LA-ROCHE INC. (US) 2015-12-29 US disclosed
US-20150284386-A1 2-OXO-2,3-DIHYDRO-INDOLES FOR THE TREATMENT OF CNS DISORDERS HOFFMANN-LA ROCHE INC. (US) 2015-10-08 US disclosed
CN-104619701-A 2-oxo-2,3-dihydro-indoles for the treatment of cns disorders HOFFMANN LA ROCHE 2015-05-13 CN 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-20150284386-A1 2-OXO-2,3-DIHYDRO-INDOLES FOR THE TREATMENT OF CNS DISORDERS HCRTR2, TPH2, CNR2 MARK3 1912/4885MARK4 3800/4885CDK2 256/4885

“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.