SCHEMBL90448

SCHEMBL90448

COCCCOc1ccc(CNC2CC2)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 3/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM1A O60341 2/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
ADRA2A P08913 1/20 0.45
HRH2 P25021 1/20 0.45
SLC6A4 P31645 1/20 0.45
HRH1 P35367 1/20 0.45
S1PR2 O95136 1/20 0.44
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL89815 0.95 MEN1 (0.54) MEN1KMT2AKDM4EALDH1A1POLB
Hydrochloric Acid SCHEMBL2806174 0.93 MEN1 (0.53) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL2085628 0.86 MEN1 (0.43) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL696157 0.85 MEN1 (0.64) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL2086320 0.85 KMT2A (0.44) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL2807945 0.85 NPC1 (0.51) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL89209 0.84 ALDH1A1 (0.51) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL89036 0.83 HTT (0.41) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL20847771 0.80 NPC1 (0.65) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL13132096 0.79 ALDH1A1 (0.52) MEN1KMT2AKDM4EALDH1A1POLB

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 MEN1 2336/4885KMT2A 3129/4885KDM4E 1650/4885

“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.