SCHEMBL27255262

SCHEMBL27255262

CC(C)(O)C(C)(C)OBc1cccc2oc3cc4ccccc4cc3c12

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ADRB2 P07550 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL24034339 0.90 ALDH1A1 (0.35) KMT2AKDM4EALDH1A1GAAMAPT
SCHEMBL22147270 0.89 HSP90AA1 (0.31)
SCHEMBL23944612 0.89 CLK1 (0.33)
SCHEMBL23944682 0.89 CLK1 (0.33)
SCHEMBL24033489 0.87 ALDH1A1 (0.33) ALDH1A1HPGD
SCHEMBL27452078 0.86 ANO1 (0.33)
SCHEMBL23944685 0.86 PDGFRB (0.36) KMT2AALDH1A1MEN1
SCHEMBL23943891 0.86
SCHEMBL24066331 0.86 AHR (0.35)
SCHEMBL19802352 0.85 ADRB2 (0.41) KMT2AKDM4EALDH1A1GAAMAPT

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
WO-2023243925-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-12-21 WO disclosed