SCHEMBL9171144

SCHEMBL9171144

O=C1CCC(=O)N1O.O=Cc1cccc(N2C(=O)C=CC2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 10/20 0.50
▸ FAAH O00519 4/20 0.50
▸ HSP90AA1 P07900 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ PKM P14618 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HPN P05981 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ FGFR1 P11362 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CCR6 P51684 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL1728478 0.86 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL1920290 0.81 L3MBTL1 (0.58) MGLLFAAHALDH1A1PKML3MBTL1
SCHEMBL5060958 0.78 MGLL (0.39) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL8002319 0.78 MGLL (0.67) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL1548309 0.77 ALDH1A1 (0.54) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL13788605 0.74 MGLL (0.76) MGLLFAAHHSP90AA1ALDH1A1PKM
Benzaldehyde SCHEMBL7538689 0.74 ALDH1A1 (0.56) ALDH1A1PKMHTTSMN1; SMN2KMT2A
SCHEMBL26099729 0.73 MGLL (0.45) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL9718088 0.72 MGLL (0.64) MGLLFAAHHSP90AA1ALDH1A1PKM
SCHEMBL25392385 0.71 TLR9 (0.47) MGLLFAAHHSP90AA1ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2686019-B1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO A POLYANIONIC POLYPEPTIDE FOR THE TREATMENT OF AIDS PASTEUR INSTITUT (FR) 2017-03-01 — — EP claimed
US-11318192-B2 Engineered proteins and methods of use EPITOPIX, LLC (US) 2022-05-03 — — US disclosed
US-20210213125-A1 ENGINEERED PROTEINS AND METHODS OF USE VAXXINOVA US, INC. 2021-07-15 — — US disclosed
EP-0405763-B1 GRF peptides MALLINCKRODT VETERINARY LTD (GB) 1995-03-29 — — EP disclosed
EP-0405763-A1 GRF peptides MALLINCKRODT VETERINARY LIMITED (GB) 1991-01-02 — — EP disclosed
WO-1990015073-A1 GRF PEPTIDES COOPERS ANIMAL HEALTH LIMITED (GB) 1990-12-13 — — WO disclosed
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