SCHEMBL18535093

SCHEMBL18535093

C=C(CC(=O)c1c(C)cc(C)cc1C)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ HTT P42858 2/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ LMNA P02545 4/20 0.39
▸ GAA P10253 2/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 1/20 0.36

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
SCHEMBL1698306 0.81 L3MBTL1 (0.44) L3MBTL1HTTMEN1KMT2AKDM4E
SCHEMBL11053483 0.80 MEN1 (0.51) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL6907962 0.76 MEN1 (0.43) L3MBTL1HTTMEN1KMT2AKDM4E
SCHEMBL4320007 0.75 ALDH1A1 (0.45) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL6908084 0.74 MEN1 (0.44) L3MBTL1HTTMEN1KMT2AKDM4E
SCHEMBL9064055 0.72 ALDH1A1 (0.46) L3MBTL1HTTMEN1KMT2AKDM4E
SCHEMBL4219708 0.72 ALDH1A1 (0.46) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL6905835 0.70 ALDH1A1 (0.41) L3MBTL1MEN1KMT2AKDM4EALDH1A1
Phosphine SCHEMBL28030392 0.70 ALDH1A1 (0.41) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL7626484 0.70 ALDH1A1 (0.46) L3MBTL1HTTMEN1KMT2AALDH1A1

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
EP-3133079-A1 DINUCLEAR METAL COMPLEXES COMPRISING CARBENE LIGANDS AND THE USE THEREOF IN OLEDS UDC Ireland Limited (IE) 2017-02-22 — — EP disclosed
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