SCHEMBL29994513

SCHEMBL29994513

COC(=O)c1ccc2c(-c3cccc(Cl)c3)c[nH]c2c1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ASH1L Q9NR48 2/20 0.71
NR4A2 P43354 2/20 0.52
NPC1 O15118 1/20 0.51
AXL P30530 1/20 0.51
IMPDH2 P12268 1/20 0.49
NEK1 Q96PY6 5/20 0.48
PDGFRB P09619 1/20 0.48
EGFR P00533 1/20 0.47
KIF11 P52732 1/20 0.47
EIF2AK2 P19525 1/20 0.47
MAP2K4 P45985 1/20 0.46
MAPK14 Q16539 1/20 0.46
MMP2 P08253 1/20 0.46
SGK1 O00141 1/20 0.46
CAMKK2 Q96RR4 1/20 0.46

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
SCHEMBL30776866 1.00 ASH1L (0.71) ASH1LNR4A2NPC1AXLIMPDH2
SCHEMBL23675210 1.00 ASH1L (0.71) ASH1LNR4A2NPC1AXLIMPDH2
SCHEMBL145474 0.86 ASH1L (0.72) ASH1LNR4A2NPC1AXLIMPDH2
SCHEMBL23675333 0.85 ASH1L (0.56) ASH1LNPC1AXLEGFRMMP2
SCHEMBL29994578 0.85 ASH1L (0.56) ASH1LNPC1AXLEGFRMMP2
SCHEMBL21004253 0.83 ASH1L (0.79) ASH1LNPC1AXLIMPDH2NEK1
SCHEMBL19608246 0.83 ASH1L (1.00) ASH1LNPC1AXLIMPDH2NEK1
SCHEMBL148296 0.82 ASH1L (0.67) ASH1LNPC1AXLIMPDH2NEK1
SCHEMBL30593653 0.82 ASH1L (0.67) ASH1LNPC1AXLIMPDH2NEK1
SCHEMBL30593680 0.82 ASH1L (0.67) ASH1LNPC1AXLIMPDH2NEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115335043-B PGDH inhibitors and methods of making and using the same 迈欧伏特治疗公司 2025-03-28 CN disclosed
CN-117377668-A Inhalant formulations of PGDH inhibitors and methods of use thereof 迈欧伏特治疗公司 2024-01-09 CN disclosed
EP-4093385-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING Myoforte Therapeutics Inc. (US) 2022-11-30 EP disclosed
CN-115335043-A PGDH inhibitors and methods of making and using 迈欧伏特治疗公司 2022-11-11 CN disclosed