SCHEMBL6259745

SCHEMBL6259745

C=Cc1cccc2nc(-c3ccccn3)c(-c3ccccn3)nc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.49
NPC1 O15118 5/20 0.49
LMNA P02545 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
HTT P42858 4/20 0.42
TP53 P04637 3/20 0.42
CCR1 P32246 2/20 0.42
CCR5 P51681 2/20 0.42
CCR8 P51685 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALPL P05186 1/20 0.42
HSP90AA1 P07900 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 4/20 0.40
METAP1 P53582 3/20 0.40
HPGD P15428 2/20 0.40

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
SCHEMBL6261668 0.78 KMT2A (0.50) KDM4ENPC1LMNASMN1; SMN2TDP1
SCHEMBL8055697 0.76 ACHE (0.55) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL13019047 0.76 KDM4E (0.53) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL2061612 0.76 KDM4E (0.70) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL608226 0.75 KDM4E (0.48) KDM4ENPC1LMNASMN1; SMN2HTT
Quinoxaline SCHEMBL27559292 0.75 TGFBR1 (0.45) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL4147124 0.75 KDM4E (0.52) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL8721465 0.74 KDM4E (0.46) KDM4ENPC1LMNASMN1; SMN2HTT
Phosphine SCHEMBL27992711 0.74 KDM4E (0.46) KDM4ENPC1LMNASMN1; SMN2HTT
SCHEMBL3210633 0.73 KDM4E (0.53) KDM4ENPC1LMNASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186067-B1 CONDUCTING POLYMERS QINETIQ LTD (GB) 2005-10-05 EP claimed
EP-1186067-B1 CONDUCTING POLYMERS QINETIQ LTD (GB) 2005-10-05 EP disclosed
US-6716371-B1 SEMICONDUCTOR WITH LAYER OF ADDITION POLYMER WITH PENDANT QUINOXALINE GROUPS QINETIQ LIMITED (GB) 2004-04-06 US disclosed