SCHEMBL4130252

SCHEMBL4130252

CCOC(=O)CN1C(=O)C(C)(C)c2cc3nc(-c4cc(C)[nH]n4)[nH]c3cc21

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.69
AURKB Q96GD4 3/20 0.69
ALDH1A1 P00352 11/20 0.41
MAPT P10636 3/20 0.41
GSK3B P49841 2/20 0.38
CHEK1 O14757 1/20 0.38
SRC P12931 1/20 0.38
CDK2 P24941 1/20 0.38
KDR P35968 1/20 0.38
FLT3 P36888 1/20 0.38
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
ELANE P08246 1/20 0.35
LMNA P02545 3/20 0.35
TP53 P04637 2/20 0.35
THRB P10828 1/20 0.35
ALDH3A1 P30838 2/20 0.34
ALDH2 P05091 1/20 0.34

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
SCHEMBL4945475 0.86 AURKA (0.92) AURKAAURKBGSK3BCHEK1SRC
SCHEMBL4133178 0.84 AURKA (0.73) AURKAAURKBGSK3BCHEK1SRC
SCHEMBL4895191 0.83 ALDH1A1 (0.47) AURKAAURKBALDH1A1MAPTGSK3B
SCHEMBL4143677 0.82 AURKA (0.73) AURKAAURKBALDH1A1GSK3BCHEK1
SCHEMBL4138252 0.82 AURKA (0.73) AURKAAURKBGSK3BCHEK1SRC
SCHEMBL4140608 0.81 AURKA (0.61) AURKAAURKBALDH1A1MAPTGSK3B
SCHEMBL4143663 0.81 AURKA (0.71) AURKAAURKBALDH1A1GSK3BCHEK1
SCHEMBL4130802 0.81 AURKA (0.61) AURKAAURKBMAPTLMNATP53
SCHEMBL4138011 0.81 AURKA (0.61) AURKAAURKBALDH1A1MAPTLMNA
SCHEMBL4134941 0.81 AURKA (0.58) AURKAAURKBKDRFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US claimed
US-20150238505-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS ALKERMES PHARMA IRELAND LTD (IE) 2015-08-27 US disclosed
US-20130309310-A1 Injectable Nanoparticulate Olanzapine Formulations ALKERMES PHARMA IRELAND LIMITED (IE) 2013-11-21 US disclosed
US-20120315336-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS ALKERMES PHARMA IRELAND LIMITED (IE) 2012-12-13 US disclosed
US-20090155331-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS ELAN PHARMA INTERNATIONAL LIMITED (IE) 2009-06-18 US disclosed
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
EP-1966213-A1 TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-09-10 EP disclosed
WO-2007068465-A1 TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-06-21 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 (5 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-20130309310-A1 Injectable Nanoparticulate Olanzapine Formulations HTR3B, HTR1A, HTR1B AURKA 1985/4885AURKB 1515/4885ALDH1A1 1756/4885
US-20150238505-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS HTR3B, HTR1A, HTR1B AURKA 1985/4885AURKB 1515/4885ALDH1A1 1756/4885
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents AAAS, CYP3A5, BRCA1 AURKA 2294/4885AURKB 2649/4885ALDH1A1 898/4885
US-20090155331-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS HTR3B, HTR1A, HTR1B AURKA 1985/4885AURKB 1515/4885ALDH1A1 1756/4885
US-20120315336-A1 INJECTABLE NANOPARTICULATE OLANZAPINE FORMULATIONS HTR3B, HTR1A, HTR1B AURKA 1985/4885AURKB 1515/4885ALDH1A1 1756/4885

“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.