SCHEMBL17224403

SCHEMBL17224403

COc1cc(/N=N/c2ccc(OC)c3ncccc23)cc(OC)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.55
KMT2A Q03164 13/20 0.55
MAPT P10636 9/20 0.55
HTT P42858 7/20 0.55
SMN1; SMN2 Q16637 7/20 0.55
TDP1 Q9NUW8 7/20 0.55
HSP90AA1 P07900 6/20 0.55
MAPK1 P28482 6/20 0.55
KDM4E B2RXH2 5/20 0.55
MMP14 P50281 1/20 0.55
NPC1 O15118 4/20 0.53
NSD2 O96028 1/20 0.53
CASP6 P55212 1/20 0.53
RAB9A P51151 3/20 0.52
OPRK1 P41145 3/20 0.52
ATM Q13315 1/20 0.52
KCNH2 Q12809 2/20 0.52
SYK P43405 2/20 0.47
MITF O75030 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL17224405 1.00 MEN1 (0.55) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224293 0.89 MEN1 (0.70) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224291 0.89 MEN1 (0.70) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224322 0.80 IDO1 (0.42) MEN1KMT2AMAPTSMN1; SMN2TDP1
SCHEMBL18528452 0.80 IDO1 (0.42) MEN1KMT2AMAPTSMN1; SMN2TDP1
SCHEMBL17224374 0.74 KDM4E (0.44) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224377 0.74 KDM4E (0.44) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224279 0.73 PDE4D (0.36) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL17224278 0.73 PDE4D (0.36) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL1506959 0.73 HTR1A (0.53) MEN1KMT2AHTTHSP90AA1KDM4E

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-3137554-A1 AZOARYLS AS REVERSIBLY MODULATABLE TUBULIN INHIBITORS Ecole Normale Superieure De Lyon (FR) 2017-03-08 EP disclosed
US-20170051149-A1 AZOARYLS AS REVERSIBLY MODULATABLE TUBULIN INHIBITORS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-02-23 US disclosed
WO-2015166295-A1 AZOARYLS AS REVERSIBLY MODULATABLE TUBULIN INHIBITORS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2015-11-05 WO disclosed