SCHEMBL31399754

SCHEMBL31399754

C=CC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.50
F13A1 P00488 7/20 0.48
TGM1 P22735 7/20 0.48
TGM3 Q08188 1/20 0.45
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
P2RY12 Q9H244 1/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX1 P07099 1/20 0.42
EPHX2 P34913 1/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41

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
SCHEMBL25313503 0.82 ALDH1A1 (0.59) USP2SMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL23643674 0.81 TGM2 (0.53) TGM2P2RY12MEN1ALDH1A1TSHR
SCHEMBL18883342 0.79 ALDH1A1 (0.47) USP2SMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL27056253 0.79 KDM4E (0.60) TGM2F13A1TGM1TGM3SMN1; SMN2
SCHEMBL23220967 0.79 TGM2 (0.57) TGM2P2RY12ALDH1A1TSHR
SCHEMBL16466467 0.78 USP2 (0.44) USP2SMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL20163037 0.78 TET2 (0.46) USP2SMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL14102930 0.78 USP2 (0.46) USP2SMN1; SMN2MEN1ALDH1A1TSHR
SCHEMBL7456438 0.77 USP2 (0.49) TGM2F13A1TGM1USP2SMN1; SMN2
SCHEMBL16103258 0.77 KDM4E (0.49) TGM2F13A1TGM1TGM3EPHX1

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-4739672-A1 NEW COMPOUNDS Aston University (GB) 2026-05-13 EP disclosed
WO-2025008626-A1 NEW COMPOUNDS ASTON UNIVERSITY (GB) 2025-01-09 WO disclosed