SCHEMBL10315451

SCHEMBL10315451

c1ccc(N(c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccccc4)c4ccccc4-c4nc5ccccc5o4)cc3)cc2)c2ccccc2-c2nc3ccccc3o2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ATM Q13315 1/20 0.43
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 2/20 0.41
USP2 O75604 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TOP2A P11388 1/20 0.40
HSD17B10 Q99714 3/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
CASP1 P29466 1/20 0.39

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
SCHEMBL13816872 0.99 PTGS2 (0.43) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315244 0.92 NPC1 (0.46) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10315454 0.91 ALDH1A1 (0.43) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315436 0.90 NPC1 (0.47) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315229 0.90 NPC1 (0.47) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315461 0.90 NPC1 (0.49) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315241 0.90 ALDH1A1 (0.43) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315453 0.87 ALDH1A1 (0.44) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315235 0.86 ALDH1A1 (0.43) PTGS2NPC1RAB9AMEN1KMT2A
SCHEMBL10315399 0.85 NPC1 (0.55) NPC1RAB9AMEN1KMT2AATM

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-2067778-B1 Quinoxaline derivative, and light emitting element, light emitting device and electronic appliance using the same SEMICONDUCTOR ENERGY LAB (JP) 2016-08-17 EP disclosed
US-8216696-B2 Quinoxaline derivative, and light emitting element, light emitting device and electronic appliance using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-07-10 US disclosed
US-8216696-B2 Quinoxaline derivative, and light emitting element, light emitting device and electronic appliance using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-07-10 US disclosed