SCHEMBL5134832

SCHEMBL5134832

CCCC(=O)Nc1ccc(N2C(=O)C=CC2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.60
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MAPT P10636 4/20 0.55
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
GAA P10253 1/20 0.52
KDM4E B2RXH2 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
MGLL Q99685 3/20 0.50
HTT P42858 2/20 0.50
THRB P10828 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50

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
SCHEMBL17860267 0.84 TERT (0.51) TP53NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL8505932 0.78 SCN2A (0.63) SMN1; SMN2MAPTALDH1A1HPGDGAA
SCHEMBL5580375 0.78 MGLL (0.60) TP53RAB9ASMN1; SMN2MAPTMGLL
SCHEMBL19414975 0.77 HPGD (0.61) TP53NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL8194022 0.76 HSP90AA1 (0.59) MAPTALDH1A1HPGDMGLLHTT
SCHEMBL22871620 0.75 SMN1; SMN2 (0.97) TP53NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL12505801 0.75 MGLL (0.56) NPC1MAPTALDH1A1HPGDGAA
SCHEMBL6075470 0.75 SMN1; SMN2 (0.74) TP53NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5542468 0.74 TP53 (0.75) TP53NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL8361539 0.74 TP53 (0.75) TP53NPC1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3236999-A1 GAS-FILLED MICROVESICLES FOR USE AS VACCINE Bracco Suisse SA (CH) 2017-11-01 EP disclosed
WO-2016102515-A1 GAS-FILLED MICROVESICLES FOR USE AS VACCINE BRACCO SUISSE SA (CH) 2016-06-30 WO disclosed
EP-1877038-A2 CELL-SURFACE DECORATION WITH ACTIVE AGENTS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2008-01-16 EP disclosed
WO-2006119121-A2 CELL-SURFACE DECORATION WITH ACTIVE AGENTS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2006-11-09 WO disclosed