SCHEMBL9384409

SCHEMBL9384409

CCN1C(=O)c2ccccc2C(CC(=O)O)(C(=O)OC)C1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
PGR P06401 1/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AKR1B1 P15121 1/20 0.36

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
SCHEMBL9388117 0.91 ALDH1A1 (0.40) CA12CA9ALDH1A1MEN1KMT2A
SCHEMBL9383572 0.89 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9385854 0.89 ALDH1A1 (0.41) ALDH1A1MEN1KMT2A
SCHEMBL9387237 0.87 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL9383419 0.85 PGR (0.39) ALDH1A1MEN1KMT2APGRMAPT
SCHEMBL9388468 0.81 TDP1 (0.44) CA12CA9ALDH1A1KMT2ATSHR
SCHEMBL9384030 0.80 TP53 (0.39) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL8319660 0.79 AKR1B1 (0.54) MEN1KMT2AAKR1B1
SCHEMBL31186345 0.79 MEN1 (0.44) ALDH1A1MEN1KMT2APGRMAPT
SCHEMBL9384412 0.78 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365324-B1 Spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PROD (US) 1994-05-04 EP disclosed
US-4927831-A PREVENTION OF DIABETES MELLITUS ASSOCIATED COMPLICATIONS AMERICAN HOME PRODUCTS (US) 1990-05-22 US disclosed
EP-0365324-A1 Spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1990-04-25 EP disclosed