SCHEMBL24036898

SCHEMBL24036898

Brc1cccc(-c2nc(-c3cccc4ccccc34)c3sc4ccccc4c3n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.41
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.38
▸ GPR55 Q9Y2T6 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAOB P27338 2/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ABCG2 Q9UNQ0 2/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ ABCB1 P08183 1/20 0.34

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
SCHEMBL17565579 0.88 EGFR (0.44) EGFRALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL16902209 0.88 ALDH1A1 (0.43) ALDH1A1MAPTSMN1; SMN2NPC1HPGD
SCHEMBL16901974 0.87 ALDH1A1 (0.37) ALDH1A1MAPTSMN1; SMN2HPGDTSHR
SCHEMBL16581302 0.87 EGFR (0.34) EGFRCNR1CNR2GPR35GPR55
SCHEMBL23327840 0.86 EGFR (0.42) EGFRALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL30536855 0.85 EGFR (0.44) EGFRCNR1CNR2GPR55ALDH1A1
SCHEMBL23327849 0.84 EGFR (0.41) EGFRALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL16902354 0.83 F9 (0.38) ALDH1A1MAPTSMN1; SMN2HPGDTSHR
SCHEMBL18158883 0.83 EGFR (0.42) EGFRCNR1CNR2GPR55ALDH1A1
SCHEMBL16902284 0.82 F9 (0.37) ALDH1A1MAPTSMN1; SMN2HPGDTSHR

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-2021230651-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-11-18 — — WO disclosed
Send feedback