SCHEMBL1664809

SCHEMBL1664809

Cn1ccc(C(=O)Nc2ccc(Nc3ccc(Nc4ccc(N5CCC(O)CC5)cc4)cc3)c(Cl)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.42
RAB9A P51151 6/20 0.40
NPC1 O15118 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
USP2 O75604 2/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 3/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 2/20 0.39
HPGDS O60760 1/20 0.39
MAPK1 P28482 1/20 0.39
MCL1 Q07820 1/20 0.39
CSF1R P07333 1/20 0.39
LCK P06239 1/20 0.39
MAPK14 Q16539 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL1665731 0.96 LMNA (0.43) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL1664811 0.96 LMNA (0.43) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL1665848 0.89 PDE7A (0.40) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL17072271 0.88 KMT2A (0.47) EGFRRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL1664624 0.87 ALDH1A1 (0.46) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL1667332 0.86 MAPT (0.48) RAB9ANPC1SMN1; SMN2USP2ALDH1A1
SCHEMBL1662766 0.86 RAB9A (0.51) RAB9ANPC1SMN1; SMN2USP2ALDH1A1
SCHEMBL1664440 0.86 HPGDS (0.41) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL1664640 0.86 ALDH1A1 (0.46) EGFRRAB9ANPC1SMN1; SMN2USP2
SCHEMBL1665852 0.85 NPC1 (0.43) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A

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-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed