SCHEMBL10366644

SCHEMBL10366644

O=C1CC2(C(=O)N1)C(=O)N1CCCc3cccc2c31

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
GAA P10253 1/20 0.51
CES1 P23141 2/20 0.43
USP2 O75604 1/20 0.41
MAP2K1 Q02750 1/20 0.39
HTR2C P28335 1/20 0.38
AKR1B1 P15121 2/20 0.37

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
SCHEMBL10366865 0.79 AKR1B1 (0.46) ALDH1A1GAACES1AKR1B1
SCHEMBL10367698 0.79 AKR1B1 (0.38) ALDH1A1GAACES1AKR1B1
SCHEMBL8807959 0.75 AKR1B1 (0.36) AKR1B1
SCHEMBL10860119 0.75 ALDH1A1 (0.53) ALDH1A1GAACES1USP2MAP2K1
SCHEMBL10856173 0.75 AKR1B1 (0.36) ALDH1A1GAAAKR1B1
SCHEMBL6746228 0.70 MAP2K1 (0.53) ALDH1A1GAACES1USP2MAP2K1
SCHEMBL9194271 0.70 NPC1 (0.44) AKR1B1
SCHEMBL28746487 0.68 ALDH1A1 (0.46) ALDH1A1GAACES1USP2MAP2K1
SCHEMBL13306376 0.67 SCN9A (0.45) ALDH1A1GAACES1USP2
SCHEMBL3349347 0.66 ALDH1A1 (0.38) ALDH1A1GAACES1USP2MAP2K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60142984-A None JP disclosed
EP-0147805-B1 SPIRO-LINKED PYRROLIDINE-2,5-DIONES AND PROCESS FOR THEIR PREPARATION KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-10-10 EP disclosed
US-4593092-A Spiro-linked pyrrolidin-2,5-dione KYORIN PHARMACEUTICAL CO., LTD. (JP) 1986-06-03 US disclosed
JP-S60142984-A NOVEL SPIROPYRROLIDINE-2,5-DIONE DERIVATIVE AND ITS PREPARATION KYORIN PHARMACEUT CO LTD 1985-07-29 JP disclosed
EP-0147805-A2 Spiro-linked pyrrolidine-2,5-diones and process for their preparation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1985-07-10 EP disclosed