SCHEMBL1666529

SCHEMBL1666529

Cc1c[nH]cc1C(=O)Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
ALDH1A1 P00352 4/20 0.41
MCL1 Q07820 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
LCK P06239 4/20 0.41
MAPK14 Q16539 4/20 0.41
PDE7A Q13946 3/20 0.40
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SLC2A1 P11166 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KCNH2 Q12809 1/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 2/20 0.39

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
SCHEMBL1665096 0.95 SLC2A1 (0.45) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL1666531 0.95 SLC2A1 (0.45) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL1667499 0.88 RAB9A (0.49) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL6125945 0.86 PDE7A (0.40) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL1664628 0.86 SLC2A1 (0.42) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL1664041 0.85 PDE7A (0.41) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL6126025 0.84 NPC1 (0.47) MAPTALDH1A1MCL1LCKMAPK14
SCHEMBL6126449 0.84 NPC1 (0.47) MAPTALDH1A1MCL1LCKMAPK14
SCHEMBL1667500 0.84 RAB9A (0.52) MAPTALDH1A1MCL1KMT2AKDM4E
SCHEMBL1664832 0.84 PDE7A (0.41) MAPTALDH1A1KMT2ALCKMAPK14

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