SCHEMBL11656533

SCHEMBL11656533

COc1cc(-c2cc3ccccc3[nH]2)cc(OC)c1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.62
▸ KDM4E B2RXH2 4/20 0.62
▸ MAPT P10636 4/20 0.62
▸ NPC1 O15118 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ CASP3 P42574 2/20 0.62
▸ SENP8 Q96LD8 2/20 0.62
▸ SENP7 Q9BQF6 2/20 0.62
▸ SENP6 Q9GZR1 2/20 0.62
▸ ALDH1A1 P00352 2/20 0.62
▸ HPGD P15428 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ NPSR1 Q6W5P4 2/20 0.62
▸ TUBB4A P04350 3/20 0.60
▸ TUBB P07437 3/20 0.60
▸ TUBA3C P0DPH7 3/20 0.60
▸ TUBA1B P68363 3/20 0.60
▸ TUBA4A P68366 3/20 0.60
▸ TUBB4B P68371 3/20 0.60

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
SCHEMBL11531018 0.86 MAPT (0.60) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL30770801 0.84 RAB9A (0.67) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL10796083 0.84 RAB9A (0.67) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL11653782 0.84 RAB9A (0.62) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL1155579 0.82 KDR (0.59) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL11639272 0.82 RAB9A (0.50) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL5638213 0.81 KDM4E (0.51) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL10176553 0.80 SMO (0.51) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL11411064 0.80 CDK4 (0.67) RAB9AKDM4EMAPTNPC1MEN1
SCHEMBL17422798 0.80 RAB9A (0.61) RAB9AKDM4EMAPTNPC1MEN1

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-4096112-A POLYVINYL CHLORIDE LABAZ (FR) 1978-06-20 — — US disclosed
US-4024155-A 2-(3'-Methoxy-4'-hydroxy-phenol)-indole LABAZ (FR) 1977-05-17 — — US disclosed
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