SCHEMBL15930384

SCHEMBL15930384

CC(C)Cc1nc2ccccc2n1-c1ccc(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 6/20 0.39
DRD5 P21918 6/20 0.39
CNR2 P34972 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
PDE10A Q9Y233 2/20 0.38
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 2/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
PSMD14 O00487 1/20 0.33
RECQL P46063 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ELANE P08246 1/20 0.33
RAB9A P51151 2/20 0.32
MAPK1 P28482 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
SCHEMBL15930359 0.89 POLB (0.43) MEN1KMT2APDE10ATSHRSMN1; SMN2
SCHEMBL15930360 0.87 RAB9A (0.45) MEN1KMT2ALMNAPDE10ATSHR
SCHEMBL15930375 0.85 RAB9A (0.42) CNR2MEN1KMT2ALMNAPDE10A
SCHEMBL15930361 0.83 MAPK1 (0.50) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL15930381 0.81 ALDH1A1 (0.42) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL9889944 0.80 KDM4E (0.43) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL16482230 0.80 PTPN1 (0.34) DRD1DRD5MEN1KMT2ALMNA
SCHEMBL15930315 0.79 ESR2 (0.51) MEN1KMT2ARECQLRAB9AMAPK1
SCHEMBL15930387 0.79 ALDH1A1 (0.47) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL17246179 0.79 KDM4E (0.46) MEN1KMT2ALMNATSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140217393-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. 2014-08-07 US disclosed
US-20140217393-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. 2014-08-07 US disclosed