SCHEMBL19009532

SCHEMBL19009532

Cc1nc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.54
KMT2A Q03164 9/20 0.54
HPGD P15428 7/20 0.54
ALDH1A1 P00352 6/20 0.54
MAPT P10636 6/20 0.54
NTSR1 P30989 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
KDM4E B2RXH2 4/20 0.47
LMNA P02545 2/20 0.47
GLA P06280 1/20 0.47
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
ADORA3 P0DMS8 2/20 0.46
RAC1 P63000 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL16189308 0.98 MEN1 (0.53) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL16189282 0.93 MEN1 (0.47) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL19037219 0.92 L3MBTL1 (0.47) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL7823188 0.91 ADORA3 (0.47) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL19009659 0.89 L3MBTL1 (0.44) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL30112574 0.84 ALDH1A1 (0.51) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL30112646 0.81 CYP19A1 (0.47) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL16436822 0.81 MEN1 (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL30112644 0.81 TP53 (0.48) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL27992753 0.81 RAC1 (0.46) MEN1KMT2AHPGDALDH1A1MAPT

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-20170179402-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed
US-20170179402-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed