SCHEMBL3420510

SCHEMBL3420510

O=C1CCCN(C(=O)O)[C@H]1O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MCL1 Q07820 1/20 0.31
OPRK1 P41145 1/20 0.31
SLC18A3 Q16572 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4554691 0.79 ALDH1A1 (0.34) LMNAALDH1A1MCL1OPRK1SLC18A3
SCHEMBL4843284 0.78 CA1 (0.34) LMNAALDH1A1MCL1OPRK1KMT2A
SCHEMBL27751204 0.78 LMNA (0.31) LMNAALDH1A1MCL1OPRK1
SCHEMBL1817592 0.73 RIPK1 (0.33) LMNAALDH1A1MAPTL3MBTL1
SCHEMBL28107926 0.71 SLC18A3 (0.44) LMNAALDH1A1MCL1SLC18A3MAPT
SCHEMBL6677041 0.70 MEN1 (0.35) ALDH1A1OPRK1KMT2A
SCHEMBL27657788 0.70
SCHEMBL6108396 0.69 SMN1; SMN2 (0.36) ALDH1A1MCL1L3MBTL1
SCHEMBL6107480 0.69 HSD11B1 (0.38) ALDH1A1
SCHEMBL6107095 0.69 HSD11B1 (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2212332-A1 SUBSTITUTED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2010-08-04 EP disclosed
WO-2009033581-A1 SUBSTITUTED TRICYCLIC COMPOUNDS AND METHODS OF USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-03-19 WO disclosed