SCHEMBL23976280

SCHEMBL23976280

CC(C)NCC(O)COCCCCOCC(O)CNC(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.53
ADRB1 P08588 3/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CYP2D6 P10635 1/20 0.47
ADRB3 P13945 1/20 0.47
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 2/20 0.45

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
SCHEMBL11340743 0.93 USP2 (0.58) ADRB2ADRB1MEN1KMT2AUSP2
SCHEMBL20670875 0.91 USP2 (0.61) ADRB2ADRB1MEN1KMT2AUSP2
SCHEMBL1551336 0.91 USP2 (0.61) ADRB2ADRB1MEN1KMT2AUSP2
SCHEMBL23334641 0.91 USP2 (0.61) ADRB2ADRB1MEN1KMT2AUSP2
SCHEMBL12441491 0.91 USP2 (0.61) ADRB2ADRB1MEN1KMT2AUSP2
SCHEMBL9759886 0.84 ADRB2 (0.50) ADRB2ADRB1MEN1KMT2ACYP2D6
SCHEMBL18541707 0.83 USP2 (0.51) USP2HTT
SCHEMBL12441483 0.83 USP2 (0.51) USP2HTT
Hydrochloric Acid SCHEMBL11299274 0.82 USP2 (0.50) MEN1KMT2AUSP2HTT
SCHEMBL179147 0.81 ADRB2 (0.49) ADRB2ADRB1MEN1KMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021222752-A1 PORT-ACCESSIBLE MULTIDIRECTIONAL REINFORCED MINIMALLY INVASIVE COLLAGEN DEVICE FOR SOFT TISSUE REPAIR HARBOR MEDTECH, INC. (US) 2021-11-04 WO disclosed
US-20210338886-A1 PORT-ACCESSIBLE MULTIDIRECTIONAL REINFORCED MINIMALLY INVASIVE COLLAGEN DEVICE FOR SOFT TISSUE REPAIR HARBOR MEDTECH, INC. 2021-11-04 US disclosed