SCHEMBL7560552

SCHEMBL7560552

COc1c(CO[C@H]2CN(C(=O)O)CC[C@@H]2c2ccc(OC[C@@H](O)COCc3ccccc3)cc2)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
REN P00797 8/20 0.37
DRD4 P21917 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM1A O60341 2/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 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
SCHEMBL6041632 1.00 PRMT5 (0.42) PRMT5WDR77POLBL3MBTL1REN
SCHEMBL6042712 0.92 PRMT5 (0.36) PRMT5WDR77POLBL3MBTL1REN
SCHEMBL6042707 0.92 PRMT5 (0.36) PRMT5WDR77POLBL3MBTL1REN
SCHEMBL6041613 0.85 REN (0.51) REN
SCHEMBL6041619 0.85 REN (0.51) REN
SCHEMBL6041261 0.84 REN (0.41) RENALDH1A1RAB9A
SCHEMBL6041322 0.83 REN (0.40) RENRAB9AKDM1AMAOAMAOB
SCHEMBL6042744 0.83 HPGD (0.37) PRMT5WDR77RENDRD4KMT2A
SCHEMBL6043107 0.83 REN (0.36) PRMT5WDR77RENDRD4KMT2A
SCHEMBL6043099 0.83 REN (0.36) PRMT5WDR77RENDRD4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 US disclosed