SCHEMBL3618238

SCHEMBL3618238

CC(SSc1ccccn1)c1ccc(C(=O)NCCCCC(C(=O)ON2C(=O)CCC2=O)S(=O)(=O)O)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
TP53 P04637 1/20 0.37
PTAFR P25105 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
DRD3 P35462 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HDAC6 Q9UBN7 3/20 0.32
HDAC3 O15379 1/20 0.32

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
SCHEMBL179849 0.85 SMN1; SMN2 (0.40) SMN1; SMN2RAB9ANPC1TP53NFKB1
SCHEMBL16279731 0.84 RAB9A (0.38) SMN1; SMN2RAB9ANPC1TP53PTAFR
SCHEMBL15994284 0.80 HPGD (0.38) LMNAALDH1A1
SCHEMBL14868085 0.79 NPC1 (0.45) SMN1; SMN2RAB9ANPC1TP53NFKB1
SCHEMBL18726765 0.78 HDAC1 (0.40) LMNAALDH1A1HDAC6
SCHEMBL1389471 0.78 LMNA (0.34) SMN1; SMN2RAB9ANPC1KMT2ALMNA
SCHEMBL29386113 0.77 MAPT (0.36) SMN1; SMN2RAB9ANPC1TP53KMT2A
SCHEMBL42875 0.77 MAPT (0.36) SMN1; SMN2RAB9ANPC1TP53KMT2A
SCHEMBL321300 0.77 SMN1; SMN2 (0.35) SMN1; SMN2RAB9ANPC1TP53PTAFR
SCHEMBL14872074 0.76 NAAA (0.52) SMN1; SMN2RAB9ANPC1TP53NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160074042-A1 NEURAL IMPLANT MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2016-03-17 US disclosed
US-8696762-B2 Implant of cross-linked spider silk threads MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2014-04-15 US disclosed
US-20130190786-A1 NEURAL IMPLANT MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2013-07-25 US disclosed
EP-2097117-B1 IMPLANT OF CROSS-LINKED SPIDER SILK THREADS HANNOVER MED HOCHSCHULE (DE) 2013-05-22 EP disclosed
US-20100228359-A1 IMPLANT OF CROSS-LINKED SPIDER SILK THREADS MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2010-09-09 US disclosed
EP-2097117-A1 IMPLANT OF CROSS-LINKED SPIDER SILK THREADS Medizinische Hochschule Hannover (DE) 2009-09-09 EP disclosed
WO-2008071226-A1 IMPLANT OF CROSS-LINKED SPIDER SILK THREADS MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2008-06-19 WO disclosed