SCHEMBL25793463

SCHEMBL25793463

C=CNCCCNC(=O)CCCCCNC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.43
EPHX2 P34913 3/20 0.43
CASP2 P42575 1/20 0.43
FAAH O00519 4/20 0.42
SLC6A5 Q9Y345 2/20 0.42
TSHR P16473 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NAAA Q02083 1/20 0.41
DNM1 Q05193 2/20 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
SCHEMBL25793510 0.86 CASP2 (0.55) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL23760291 0.85 CASP2 (0.47) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL24811369 0.83 SMN1; SMN2 (0.44) EPHX2CASP2FAAHSLC6A5TSHR
SCHEMBL15362884 0.82 ALDH1A1 (0.54) LPAR1EPHX2FAAHSLC6A5TSHR
SCHEMBL21172672 0.81 CASP2 (0.47) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL19059496 0.80 EPHX2 (0.53) EPHX2CASP2FAAHSLC6A5TSHR
SCHEMBL12295581 0.80 EPHX2 (0.49) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL25030622 0.80 EPHX2 (0.53) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL20202534 0.80 EPHX2 (0.53) LPAR1EPHX2CASP2FAAHSLC6A5
SCHEMBL23616303 0.79 CASP2 (0.52) LPAR1EPHX2CASP2FAAHSLC6A5

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
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed