SCHEMBL27362469

SCHEMBL27362469

CC(C)(C)Oc1ccc(-c2nc(Cl)nc(-c3ccc(-c4ccccc4)cc3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.43
L3MBTL1 Q9Y468 5/20 0.42
HPGD P15428 6/20 0.40
ALDH1A1 P00352 5/20 0.40
LMNA P02545 3/20 0.39
RIPK1 Q13546 1/20 0.39
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
S1PR1 P21453 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
DPP4 P27487 1/20 0.36
GLA P06280 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL18468613 0.81 L3MBTL1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL16332656 0.81 L3MBTL1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL29385431 0.81 L3MBTL1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL18468590 0.81 L3MBTL1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL4201340 0.81 L3MBTL1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL7861289 0.81 NPC1 (0.43) CHRNA7ALDH1A1LMNARIPK1MEN1
SCHEMBL31657738 0.78 L3MBTL1 (0.48) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL31657739 0.78 L3MBTL1 (0.48) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL4031522 0.77 MEN1 (0.54) L3MBTL1HPGDALDH1A1LMNAMEN1
SCHEMBL28243450 0.77 L3MBTL1 (0.58) L3MBTL1HPGDALDH1A1LMNAMEN1

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
WO-2024039056-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-02-22 WO disclosed