SCHEMBL24048615

SCHEMBL24048615

CC(C)(Oc1ccc(C(=O)OCC2CO2)cc1)Oc1ccc(C(=O)OCC2CO2)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
HPGD P15428 3/20 0.43
MAPT P10636 2/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP1A2 P05177 1/20 0.43
PPARG P37231 1/20 0.43
HIF1A Q16665 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.39
CHRNB2 P17787 3/20 0.39
CHRNA7 P36544 3/20 0.39
CHRNA4 P43681 3/20 0.39
CHRNA5 P30532 2/20 0.39
MGLL Q99685 2/20 0.38

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
SCHEMBL24049024 0.88 MGLL (0.40) TP53HPGDMAPTTSHRMEN1
SCHEMBL38933 0.84 MGLL (0.47) TP53MEN1KMT2AALDH1A1CYP1A2
SCHEMBL22357194 0.84 MGLL (0.47) TP53MEN1KMT2AALDH1A1CYP1A2
SCHEMBL17233757 0.84 CA1 (0.51) HPGDMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL1029379 0.83 SMN1; SMN2 (0.46) TP53HPGDTSHRMEN1KMT2A
Water SCHEMBL28237529 0.83 MGLL (0.46) TP53MEN1KMT2AALDH1A1CYP1A2
SCHEMBL27538597 0.83 MGLL (0.46) TP53MEN1KMT2AALDH1A1CYP1A2
SCHEMBL3240666 0.82 MAPT (0.45) TP53HPGDMAPTTSHRMEN1
SCHEMBL10390306 0.82 MEN1 (0.56) TP53HPGDMAPTTSHRMEN1
SCHEMBL19892095 0.82 ALDH1A1 (0.55) TP53HPGDMAPTTSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220119588-A1 RECYCLABLE AND REWORKABLE EPOXY RESINS ADITYA BIRLA CHEMICALS (THAILAND) LTD. (EPOXY DIVISION) (TH) 2022-04-21 US disclosed
US-20210363287-A1 RECYCLABLE AND REWORKABLE EPOXY RESINS ADITYA BIRLA CHEMICALS (THAILAND) LTD. (EPOXY DIVISION) (TH) 2021-11-25 US disclosed
US-20210363288-A1 RECYCLABLE AND REWORKABLE EPOXY RESINS ADITYA BIRLA CHEMICALS (THAILAND) LTD. (EPOXY DIVISION) (TH) 2021-11-25 US disclosed