SCHEMBL22972833

SCHEMBL22972833

C/C(=C\CCN1C(=O)C=CC1=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 8/20 0.43
PTGS2 P35354 8/20 0.43
MGLL Q99685 9/20 0.42
FAAH O00519 4/20 0.42
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HPGD P15428 2/20 0.41
HSP90AA1 P07900 1/20 0.41
TLR9 Q9NR96 1/20 0.41
TP53 P04637 1/20 0.41
PKM P14618 1/20 0.41
XBP1 P17861 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR35 Q9HC97 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
SCHEMBL22972834 1.00 PTGS1 (0.43) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL22972832 0.82 OPRM1 (0.43) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL20262963 0.79 ALDH1A1 (0.52) ALDH1A1PKM
SCHEMBL22972828 0.78 MGLL (0.36) PTGS1PTGS2MGLLALDH1A1LMNA
SCHEMBL22972829 0.78 MGLL (0.36) PTGS1PTGS2MGLLALDH1A1LMNA
SCHEMBL2866493 0.77 CA12 (0.49) ALDH1A1HPGDPKMRAB9ASMN1; SMN2
SCHEMBL27830601 0.76 CD81 (0.35)
SCHEMBL20262968 0.73 KDM4E (0.36) ALDH1A1LMNAPKMMAPK1
SCHEMBL129059 0.71 CD81 (0.44) PTGS1
SCHEMBL1765494 0.71 CD81 (0.44) PTGS1

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
EP-3221698-B1 POROUS MEMBRANES WITH A POLYMER GRAFTING, METHODS AND USES THEREOF Global Life Sciences Solutions Operations UK Ltd (GB) 2021-02-17 EP claimed