SCHEMBL4782085

SCHEMBL4782085

COc1ccc2[nH]c(-c3c(NS(=O)(=O)c4ccccc4)cc[nH]c3=O)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCAT1 P54687 1/20 0.49
▸ MAPT P10636 4/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ TUBB4A P04350 1/20 0.47
▸ TUBB P07437 1/20 0.47
▸ TUBA3C P0DPH7 1/20 0.47
▸ TUBA1B P68363 1/20 0.47
▸ TUBA4A P68366 1/20 0.47
▸ TUBB4B P68371 1/20 0.47
▸ TUBB3 Q13509 1/20 0.47
▸ TUBB2A Q13885 1/20 0.47
▸ TUBB8 Q3ZCM7 1/20 0.47
▸ TUBA3E Q6PEY2 1/20 0.47
▸ TUBA1A Q71U36 1/20 0.47
▸ TUBA1C Q9BQE3 1/20 0.47
▸ TUBB6 Q9BUF5 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
SCHEMBL4796043 0.85 ALDH1A1 (0.51) BCAT1MAPTMEN1KMT2AKDM4E
SCHEMBL4782144 0.81 SLC40A1 (0.52) BCAT1MAPTMEN1KMT2AKDM4E
SCHEMBL4782089 0.81 KDM4E (0.51) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4781252 0.79 KDM4E (0.52) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4795187 0.79 MAPT (0.43) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4781385 0.76 MAPT (0.43) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4782567 0.75 IGF1R (0.48) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4782147 0.74 IGF1R (0.49) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4781983 0.73 KDM4E (0.50) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4780159 0.73 KDM4E (0.45) MAPTMEN1KMT2AKDM4ENPC1

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
WO-2008025526-A1 INDOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-06 — — WO claimed
WO-2008025526-A1 INDOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-06 — — WO disclosed
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