SCHEMBL7779341

SCHEMBL7779341

COC(=O)C1(C=O)C=Nc2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.35
ITGA4 P13612 1/20 0.35
HTT P42858 2/20 0.33
TRPA1 O75762 5/20 0.32
POLB P06746 3/20 0.32
GAA P10253 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.31
TACR1 P25103 1/20 0.30
TACR3 P29371 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL27557704 0.81 TRPA1 (0.30) TRPA1
SCHEMBL4624447 0.76 MEN1 (0.37) KMT2AMEN1ALDH1A1MAPTITGA4
SCHEMBL28679428 0.74 MAPT (0.38) KMT2AMEN1ALDH1A1MAPTITGA4
SCHEMBL7782980 0.72 ALDH1A1 (0.31) ALDH1A1MAPTITGA4
SCHEMBL38654837 0.69 LMNA (0.31) HTTLMNA
Hydrochloric Acid SCHEMBL27684552 0.69 PDE7A (0.31) ALDH1A1MAPTITGA4TRPA1
SCHEMBL27871252 0.69
SCHEMBL4625185 0.68 MAPT (0.34) KMT2AALDH1A1MAPTITGA4TRPA1
SCHEMBL28846712 0.67
SCHEMBL28330586 0.66

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
EP-0552329-B1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 2001-10-04 EP disclosed
US-5409949-A Methylen-oxindole derivatives compositions and tyrosine kinase inhibition therewith FARMITALIA CARLO ERBA S.R.L. (IT) 1995-04-25 US disclosed
EP-0552329-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1993-07-28 EP disclosed
EP-0525472-A2 Methylen-oxindole derivatives and process for their preparation PHARMACIA S.p.A. (IT) 1993-02-03 EP disclosed
WO-1993001182-A1 METHYLEN-OXINDOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1993-01-21 WO disclosed