SCHEMBL23652276

SCHEMBL23652276

CCCC(=O)N[C@H]1CC[C@@H](NC(=O)OC)CC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MTNR1A P48039 3/20 0.45
MTNR1B P49286 3/20 0.45
SMYD3 Q9H7B4 1/20 0.45
GNAI3 P08754 1/20 0.45
GNAO1 P09471 1/20 0.45
GNAI1 P63096 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 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
SCHEMBL25662474 1.00 ALDH1A1 (0.46) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL5988081 0.88
SCHEMBL20581686 0.88 SMN1; SMN2 (0.56) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL14199968 0.88 SMN1; SMN2 (0.56) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL22858737 0.84 SMYD3 (0.48) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL8464579 0.82 EPHX1 (0.46) ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL2050427 0.82
SCHEMBL13573015 0.81 EPHX2 (0.54) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL11822035 0.81 EPHX2 (0.54) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL20999175 0.80 SMN1; SMN2 (0.63) ALDH1A1MEN1MAPTHPGDKMT2A

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
EP-3851469-B1 POLYURETHANE/UREA MATERIALS COMMW SCIENT IND RES ORG (AU) 2023-05-10 EP disclosed
EP-3851469-A1 POLYURETHANE/UREA MATERIALS Commonwealth Scientific and Industrial Research Organisation (AU) 2021-07-21 EP disclosed