SCHEMBL23846112

SCHEMBL23846112

CC1CC2CC(C1)CC(C)(NC(=O)COCCOCC(=O)NC13CC4CC(CC(C4)C1)C3)C2

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.61
ALDH1A1 P00352 6/20 0.52
EPHX2 P34913 5/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
LMNA P02545 1/20 0.49
THRB P10828 1/20 0.49
HTT P42858 1/20 0.49
ATM Q13315 1/20 0.46
POLB P06746 2/20 0.43

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
SCHEMBL18201484 0.77 OPRK1 (0.68) OPRK1ALDH1A1EPHX2KMT2AMAPT
SCHEMBL3455397 0.76 OPRK1 (0.66) OPRK1ALDH1A1EPHX2KMT2AMAPT
Tromantadine SCHEMBL148486 0.76 OPRK1 (1.00) OPRK1ALDH1A1EPHX2KMT2AMAPT
SCHEMBL20445509 0.75 KMT2A (0.39) ALDH1A1EPHX2KMT2ASMN1; SMN2LMNA
Tromantadine SCHEMBL1376070 0.75 OPRK1 (0.97) OPRK1ALDH1A1EPHX2KMT2AMAPT
Tromantadine SCHEMBL1651361 0.74 OPRK1 (0.94) OPRK1ALDH1A1EPHX2KMT2AMAPT
SCHEMBL11355333 0.73 OPRK1 (0.61) OPRK1ALDH1A1EPHX2KMT2AMAPT
SCHEMBL22072734 0.71 OPRK1 (0.56) OPRK1ALDH1A1EPHX2KMT2AMAPT
SCHEMBL20290187 0.71 EPHX1 (0.44) ALDH1A1EPHX2KMT2ASMN1; SMN2
SCHEMBL23960193 0.70 OPRK1 (0.66) OPRK1ALDH1A1EPHX2KMT2AMAPT

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
US-20210292536-A1 RESIN COMPOSITION, ADHESIVE MEMBER, AND DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-23 US disclosed