SCHEMBL25816088

SCHEMBL25816088

CN1c2ccccc2N(S)c2cccnc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.37
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
BRD4 O60885 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAOA P21397 1/20 0.31
SRC P12931 1/20 0.31
AVPR2 P30518 1/20 0.31

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
SCHEMBL8101449 0.82 MYC (0.40) MYCADORA3ADORA2AADORA1KMT2A
SCHEMBL12642490 0.78
SCHEMBL8103219 0.76 ADORA3 (0.39) MYCADORA3ADORA2AADORA1KMT2A
SCHEMBL22883432 0.74 MYC (0.34) MYCADORA3ADORA2AADORA1KMT2A
SCHEMBL8790761 0.71 TTR (0.50) ALDH1A1BRD4
SCHEMBL17952757 0.70 ALDH1A1 (0.41) ALDH1A1MAPTBRD4LMNAMAOA
SCHEMBL11420554 0.69 KDM4E (0.43) MYCALDH1A1SMN1; SMN2
SCHEMBL19481568 0.69 HTR2A (0.41) ADORA3KMT2AALDH1A1MAPTMEN1
SCHEMBL27027251 0.69 ADRA2A (0.47) MYCKMT2AALDH1A1MEN1LMNA
SCHEMBL8103434 0.68 ADRA2A (0.34) MYCADORA3ADORA2AADORA1BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4210454-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2023-07-12 EP disclosed