SCHEMBL29989028

SCHEMBL29989028

CC(C)c1ccc(CO)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.44
ESR2 Q92731 5/20 0.44
EGLN2 Q96KS0 1/20 0.41
PANK3 Q9H999 2/20 0.39
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
HRH3 Q9Y5N1 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL5109247 1.00 ESR1 (0.44) ESR1ESR2EGLN2PANK3PRMT5
SCHEMBL23525242 0.84 ESR1 (0.42) ESR1ESR2EGLN2PANK3HRH3
SCHEMBL12185864 0.84 ESR1 (0.42) ESR1ESR2PANK3PRMT5WDR77
SCHEMBL24501867 0.82 ESR1 (0.39) ESR1ESR2EGLN2PANK3S1PR1
SCHEMBL23583491 0.81 ESR1 (0.40) ESR1ESR2PANK3NPC1POLB
SCHEMBL31541690 0.81 ESR1 (0.40) ESR1ESR2EGLN2HRH3HSD17B10
SCHEMBL5513086 0.81 KDM4E (0.43) ESR1ESR2PANK3PRMT5WDR77
SCHEMBL2153037 0.79 ESR1 (0.37) ESR1ESR2EGLN2HSD17B10NPC1
SCHEMBL12020745 0.79 ESR1 (0.44) ESR1ESR2PANK3GABRA1
SCHEMBL14621143 0.79 ESR1 (0.41) ESR1ESR2PANK3PRMT5WDR77

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024081653-A2 METHODS OF LOWERING MIRO2 TO TREAT NEURODEGENERATIVE DISEASES ACUREX BIOSCIENCES CORPORATION (US) 2024-04-18 WO disclosed
EP-4301759-A2 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF The Board of Trustees of the Leland Stanford Junior University (US) 2024-01-10 EP disclosed
WO-2022216386-A9 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-12-01 WO disclosed
WO-2022216386-A2 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-10-13 WO disclosed