SCHEMBL6940601

SCHEMBL6940601

NNC(=O)c1ccccc1SCC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 3/20 0.51
HPGD P15428 2/20 0.46
MEN1 O00255 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KDM4E B2RXH2 1/20 0.43
METAP2 P50579 1/20 0.39
CRBN Q96SW2 1/20 0.39
NPC1 O15118 1/20 0.39
EPHX2 P34913 1/20 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
SCHEMBL6935543 0.79 HPGD (0.48) ALDH1A1KMT2AHPGDMEN1RAB9A
SCHEMBL5300150 0.75 PPM1D (0.44) ALDH1A1KMT2AHPGDRAB9AKDM4E
SCHEMBL80348 0.73 ALDH1A1 (0.43) ALDH1A1KMT2AHPGDRAB9ASMN1; SMN2
SCHEMBL6942406 0.73 HPGD (0.57) ALDH1A1KMT2AHPGDMAPTTDP1
SCHEMBL5305669 0.73 CTSD (0.42) ALDH1A1KMT2AHPGDMEN1RAB9A
SCHEMBL77546 0.72 KMT2A (0.40) ALDH1A1KMT2AHPGDMEN1RAB9A
SCHEMBL6937373 0.71 KMT2A (0.70) ALDH1A1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL3954239 0.71 HDAC3 (0.52) ALDH1A1KMT2AHPGDMEN1RAB9A
SCHEMBL6939482 0.71 KMT2A (0.50) ALDH1A1KMT2AHPGDGAATDP1
SCHEMBL77960 0.70 ACHE (0.44) ALDH1A1KMT2AHPGDGAAHSD17B10

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-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP claimed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO claimed