SCHEMBL89459

SCHEMBL89459

COCCCOc1cc(NC2CC2)ccc1C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.38
HTT P42858 1/20 0.38
MELK Q14680 1/20 0.37
PPARD Q03181 2/20 0.37
KDR P35968 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
FAAH O00519 1/20 0.37
POLB P06746 1/20 0.37
AXL P30530 1/20 0.37
FLT3 P36888 1/20 0.37
TYRO3 Q06418 1/20 0.37
MERTK Q12866 1/20 0.37
GAS6 Q14393 1/20 0.37

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
SCHEMBL90434 0.80 ROCK2 (0.38) LMNAHTTKDM4EALDH1A1
SCHEMBL89853 0.79 CYP2C9 (0.39) LMNAMAPTSMN1; SMN2L3MBTL1HTT
SCHEMBL8236634 0.79 ALDH1A1 (0.34) LMNAMAPTL3MBTL1HTTKDM4E
SCHEMBL89390 0.76 IRAK4 (0.38) KDM4EALDH1A1
SCHEMBL89959 0.76 ULK1 (0.44) FLT3
SCHEMBL88798 0.76 LMNA (0.60) LMNAMAPTSMN1; SMN2TDP1L3MBTL1
SCHEMBL1911358 0.74 LMNA (0.47) LMNAMAPTSMN1; SMN2L3MBTL1HTT
SCHEMBL89047 0.74 PTGDR2 (0.49) LMNAMAPTSMN1; SMN2L3MBTL1HTT
SCHEMBL15087904 0.74 LMNA (0.47) LMNAMAPTSMN1; SMN2L3MBTL1HTT
SCHEMBL25039605 0.72 HTT (0.39) LMNAL3MBTL1HTTKDM4EALDH1A1

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
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
US-8129411-B2 Organic compounds NOVARTIS AG (CH) 2012-03-06 US disclosed
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
US-20090192148-A1 Organic Compounds NOVARTIS AG (CH) 2009-07-30 US disclosed
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 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-20090192148-A1 Organic Compounds REN, ACE, AGTR1 LMNA 1594/4885MAPT 1089/4885SMN1; SMN2 1867/4885

“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.