SCHEMBL30658149

SCHEMBL30658149

COc1ccc(-c2cc(-c3ccc(F)cc3)[o+]c(-c3ccc(F)cc3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ NFE2L2 Q16236 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ ABL1 P00519 1/20 0.44
▸ ABCB1 P08183 1/20 0.44
▸ BCR P11274 1/20 0.44
▸ FLT3 P36888 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL6688965 0.91 NPC1 (0.55) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL11050461 0.87 ABL1 (0.50) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL11050455 0.84 NPC1 (0.46) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL29968150 0.84 ABL1 (0.55) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL6685513 0.84 ABL1 (0.55) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL30489763 0.84 ABL1 (0.55) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL6686384 0.84 ABL1 (0.55) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL7913407 0.84 ABL1 (0.55) NPC1RAB9ATP53MAPK1CASP3
Perchlorate SCHEMBL11044837 0.84 NPC1 (0.51) NPC1RAB9ATP53MAPK1CASP3
SCHEMBL8744514 0.83 ABL1 (0.50) NPC1RAB9ATP53MAPK1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117098610-A Method for producing an optical effect layer comprising magnetic or magnetizable pigment particles and exhibiting more than one marking 锡克拜控股有限公司 2023-11-21 — — CN claimed
CN-117098610-A Method for producing an optical effect layer comprising magnetic or magnetizable pigment particles and exhibiting more than one marking 锡克拜控股有限公司 2023-11-21 — — CN disclosed
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