SCHEMBL22766664

SCHEMBL22766664

c1ccc(-c2nc(-c3ccccc3)nc(-c3c4ccccc4c(-c4ccccc4-c4ccccc4)c4ccccc34)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR55 Q9Y2T6 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ TSHR P16473 3/20 0.42
▸ ADORA3 P0DMS8 2/20 0.42
▸ ADORA2A P29274 2/20 0.42
▸ ADORA2B P29275 2/20 0.42
▸ ADORA1 P30542 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ ATM Q13315 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41

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
SCHEMBL22766459 0.96 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL22766809 0.96 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL22766704 0.96 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL22766665 0.96 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL22766641 0.96 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL12600796 0.94 GPR55 (0.47) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL21476586 0.91 GPR55 (0.44) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL23590346 0.89 TSHR (0.44) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL22766544 0.89 GPR55 (0.43) GPR55L3MBTL1TSHRADORA3ADORA2A
SCHEMBL12200477 0.88 L3MBTL1 (0.56) L3MBTL1ADORA3ADORA2AADORA2BADORA1

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
US-20200388767-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-10 — — US disclosed
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