SCHEMBL8719958

SCHEMBL8719958

O=C1C=C(C(=O)OCOC(=O)C2=CC(=O)Cc3ccccc32)c2ccccc2C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 1/20 0.37
BCHE P06276 1/20 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
SCHEMBL27661294 0.88 MEN1 (0.50) MEN1KMT2AGABRPGABRDGABRA1
SCHEMBL9753906 0.84 RHOA (0.53) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL11132312 0.83 ALDH1A1 (0.41) MAOAMEN1KMT2ABCHECES1
SCHEMBL703737 0.78 MAOA (0.50) MAOAMEN1KMT2ABCHECES1
SCHEMBL9145493 0.77 MAOA (0.44) MAOAMEN1KMT2ABCHECES1
SCHEMBL10783453 0.77 MAOA (0.44) MAOAMEN1KMT2ABCHECES1
SCHEMBL26339667 0.73 ALDH1A1 (0.41) MAOAMEN1KMT2ABCHECES1
SCHEMBL26337520 0.73 NPC1 (0.45) MAOAMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11068047 0.72 ALDH1A1 (0.45) MAOAMEN1KMT2AALDH1A1KDM4E
Fluorene SCHEMBL29254259 0.69 SRD5A2 (0.51) MAOAGABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5777114-A Spiro heterocycle-imidazo 1,2-a!indeno 1,2-e!pyrazine!-4'-ones, preparation thereof and drugs containing same RHONE-POULENC RORER S.A. (FR) 1998-07-07 US disclosed
EP-0093049-B1 DITHIINO (1,4) (2,3-C) PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC SANTE (FR) 1986-07-16 EP disclosed