SCHEMBL24689166

SCHEMBL24689166

CN(C)c1ccc(C2(C)CC(C)(C)c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
TDP1 Q9NUW8 5/20 0.39
HSD17B10 Q99714 3/20 0.39
CYP3A4 P08684 3/20 0.39
HPGD P15428 2/20 0.39
HIF1A Q16665 1/20 0.39
TSHR P16473 3/20 0.38
ALOX15 P16050 2/20 0.38
ATM Q13315 1/20 0.37
GAA P10253 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
OPRL1 P41146 1/20 0.35
MAPK1 P28482 3/20 0.35
RELA Q04206 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
ADRB2 P07550 1/20 0.34
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL503853 0.81 MEN1 (0.46) ALDH1A1TDP1TSHRATMSIGMAR1
SCHEMBL29436894 0.81 MEN1 (0.46) ALDH1A1TDP1TSHRATMSIGMAR1
SCHEMBL8948017 0.80 OPRM1 (0.40) ALDH1A1TDP1ATMMEN1KMT2A
Water SCHEMBL27831248 0.80 MEN1 (0.45) ALDH1A1TDP1TSHRATMSIGMAR1
SCHEMBL28524816 0.79 ATM (0.39) ALDH1A1TDP1TSHRATMSIGMAR1
SCHEMBL807632 0.79 MEN1 (0.44) ALDH1A1TDP1ATMMEN1KMT2A
SCHEMBL10711448 0.79 TP53 (0.41) ALDH1A1TDP1HSD17B10CYP3A4HIF1A
SCHEMBL9230020 0.76 ATM (0.37) ALDH1A1TDP1TSHRATMMEN1
Fluorobenzene SCHEMBL17956587 0.74 MEN1 (0.41) ALDH1A1TDP1ATMSIGMAR1MEN1
SCHEMBL9226974 0.73 MEN1 (0.44) ALDH1A1HPGDTSHRMEN1KMT2A

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-3833707-B1 CROSSLINKING OF POLYARYLETHERKETONES FREUDENBERG SE (DE) 2022-07-27 EP disclosed