SCHEMBL3709537

SCHEMBL3709537

CCOC(=O)c1ccc2c(c1)NC(=O)/C2=C(\CC)Nc1ccc(N(CCCN(C)C)C(C)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.40
MAPT P10636 7/20 0.36
RAB9A P51151 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
ALDH1A1 P00352 4/20 0.36
NPC1 O15118 3/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
CHEK1 O14757 1/20 0.35
DAPK3 O43293 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35
ABL1 P00519 1/20 0.35
LCK P06239 1/20 0.35
RET P07949 1/20 0.35
MET P08581 1/20 0.35
PDGFRB P09619 1/20 0.35
PIM1 P11309 1/20 0.35
PDGFRA P16234 1/20 0.35

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
SCHEMBL2570221 1.00 RXFP1 (0.40) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL2121820 1.00 RXFP1 (0.40) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL2572001 0.94 RXFP1 (0.39) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL479343 0.94 RXFP1 (0.39) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL2571388 0.93 CHEK1 (0.38) RXFP1MAPTRAB9AALDH1A1NPC1
SCHEMBL2122020 0.93 CHEK1 (0.38) RXFP1MAPTRAB9AALDH1A1NPC1
SCHEMBL3151227 0.92 RXFP1 (0.41) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL2119764 0.92 RXFP1 (0.41) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL31093978 0.88 RXFP1 (0.42) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL2571239 0.88 RXFP1 (0.42) RXFP1MAPTRAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010108665-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS LIFE & BRAIN GMBH (DE) 2010-09-30 WO disclosed