SCHEMBL13079694

SCHEMBL13079694

COc1ccc(-c2cc(-c3ccc(CO)cc3)cc(-c3ccc(OC)cc3)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.57
▸ TP53 P04637 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ CASP3 P42574 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ SENP8 Q96LD8 1/20 0.57
▸ SENP7 Q9BQF6 1/20 0.57
▸ SENP6 Q9GZR1 1/20 0.57
▸ ABL1 P00519 3/20 0.53
▸ ABCB1 P08183 3/20 0.53
▸ BCR P11274 3/20 0.53
▸ MAOB P27338 2/20 0.53
▸ ESR2 Q92731 1/20 0.52
▸ ERN1 O75460 1/20 0.50
▸ MTNR1A P48039 1/20 0.48
▸ MTNR1B P49286 1/20 0.48
▸ CYP11B1 P15538 1/20 0.47
▸ CYP11B2 P19099 1/20 0.47
▸ IDO1 P14902 1/20 0.47

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
SCHEMBL12386386 1.00 NPC1 (0.57) NPC1TP53MAPK1CASP3RAB9A
SCHEMBL6285826 0.94 MAOB (0.59) NPC1TP53MAPK1CASP3RAB9A
SCHEMBL2604702 0.91 ABL1 (0.62) MAPK1SMN1; SMN2ABL1ABCB1BCR
SCHEMBL26784208 0.88 ABL1 (0.62) NPC1TP53MAPK1CASP3RAB9A
SCHEMBL4181089 0.87 IDO1 (0.58) TP53SMN1; SMN2IDO1CALM1
SCHEMBL27329 0.87 IDO1 (0.58) TP53SMN1; SMN2IDO1CALM1
SCHEMBL12040004 0.86 NPC1 (0.47) NPC1TP53MAPK1CASP3RAB9A
SCHEMBL13232533 0.85 ABL1 (0.66) RAB9AABL1ABCB1BCRMAOB
SCHEMBL1477048 0.85 IDO1 (0.56) TP53SMN1; SMN2IDO1CALM1
SCHEMBL1475480 0.85 IDO1 (0.56) TP53SMN1; SMN2IDO1CALM1

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
US-7833690-B2 Photoacid generators and lithographic resists comprising the same THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2010-11-16 — — US disclosed
US-20070117043-A1 Photoacid generators and lithographic resists comprising the same NATIONAL SCIENCE FOUNDATION 2007-05-24 — — US disclosed
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