SCHEMBL25880363

SCHEMBL25880363

c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4cc5sc6ccccc6c5c5ccccc45)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.36
▸ WEE1 P30291 1/20 0.36
▸ GPR3 P46089 1/20 0.36
▸ APP P05067 1/20 0.34
▸ F9 P00740 1/20 0.34
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ALDH1A1 P00352 6/20 0.33
▸ MAPT P10636 6/20 0.33
▸ TDP1 Q9NUW8 3/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HPGD P15428 3/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL25881154 1.00 CHEK1 (0.36) CHEK1WEE1GPR3APPF9
SCHEMBL25903330 0.99 GPR3 (0.37) CHEK1WEE1GPR3APPF9
SCHEMBL25884380 0.92 ALDH1A1 (0.38) CHEK1WEE1GPR3F9MAOA
SCHEMBL25884630 0.90 LIMK1 (0.34) CHEK1WEE1APPF9ALOX5
SCHEMBL25884731 0.90 ALDH1A1 (0.35) CHEK1WEE1GPR3APPF9
SCHEMBL25880856 0.90 CHEK1 (0.33) CHEK1WEE1GPR3F9PTPN1
SCHEMBL25880587 0.90 S1PR5 (0.33) CHEK1WEE1GPR3F9ALDH1A1
SCHEMBL25880850 0.90 F9 (0.40) CHEK1WEE1F9ALDH1A1MAPT
SCHEMBL15460296 0.90 APP (0.38) CHEK1WEE1GPR3APPMAOA
SCHEMBL25880377 0.89 ALDH1A1 (0.36) CHEK1WEE1GPR3APPMAOA

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
Send feedback