SCHEMBL1289926

SCHEMBL1289926

CC1(C)c2ccccc2-c2ccc(-c3nnc(-c4cccc(-c5ccccn5)n4)o3)c(-c3nnc(-c4cccc(-c5ccccn5)n4)o3)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.40
KDM4E B2RXH2 6/20 0.40
TP53 P04637 5/20 0.40
MAPK1 P28482 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
CCR1 P32246 2/20 0.40
CCR5 P51681 2/20 0.40
CCR8 P51685 2/20 0.40
LMNA P02545 2/20 0.40
ALOX15 P16050 2/20 0.40
HTT P42858 2/20 0.40
ALPL P05186 1/20 0.40
HSP90AA1 P07900 1/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PDK2 Q15119 2/20 0.36
ALDH1A1 P00352 7/20 0.34
HPGD P15428 5/20 0.34
PKM P14618 3/20 0.34

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
SCHEMBL2365362 0.91 KDM4E (0.44) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL29756564 0.79 GUSB (0.44) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL251077 0.79 GUSB (0.44) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL2554742 0.79 KDM4E (0.60) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL12425309 0.76 KDM4E (0.69) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL6241281 0.72 KDM4E (0.43) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL2197485 0.71 SMN1; SMN2 (0.60) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL17759136 0.70 PDK2 (0.36) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL29244073 0.70 SMN1; SMN2 (0.58) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1
SCHEMBL14508147 0.69 PDK2 (0.51) SMN1; SMN2KDM4ETP53MAPK1L3MBTL1

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
WO-2016157113-A1 BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE CARRYING ARYL- OR HETEROARYLNITRIL GROUPS FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO., LTD. (JP) 2016-10-06 WO disclosed
EP-2625171-A1 PHENANTHRO[9,10-B]FURANS FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2013-08-14 EP disclosed
WO-2012045710-A1 PHENANTHRO[9,10-B]FURANS FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2012-04-12 WO disclosed