SCHEMBL9096325

SCHEMBL9096325

Cc1ccc2c(c1)C(=O)C(=O)N2CCN1CCN(Cc2ccccc2F)CC1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.60
▸ ALDH3A1 P30838 1/20 0.60
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ MAPT P10636 2/20 0.50
▸ ACHE P22303 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ KMT2A Q03164 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ DRD2 P14416 1/20 0.49
▸ DRD4 P21917 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ POLB P06746 1/20 0.47

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
SCHEMBL28075277 0.85 CA12 (0.67) ALDH1A1ALDH3A1CA12CA1CA2
SCHEMBL9096191 0.84 DRD2 (0.62) ALDH1A1ALDH3A1MAPTACHELMNA
Hydrochloric Acid SCHEMBL9096767 0.83 DRD2 (0.61) ALDH1A1ALDH3A1MAPTACHELMNA
SCHEMBL9098897 0.82 ALDH3A1 (0.57) ALDH1A1ALDH3A1CA12CA1CA2
SCHEMBL9094274 0.82 ALDH1A1 (0.62) ALDH1A1ALDH3A1CA1CA2CA9
SCHEMBL9382409 0.80 DRD2 (0.49) ALDH1A1ALDH3A1KMT2ADRD2DRD4
SCHEMBL9094820 0.78 ALDH1A1 (0.60) ALDH1A1ALDH3A1MAPTACHELMNA
SCHEMBL9095464 0.78 ALDH1A1 (0.60) ALDH1A1ALDH3A1MAPTACHELMNA
Hydrochloric Acid SCHEMBL9096336 0.77 ALDH1A1 (0.58) ALDH1A1ALDH3A1MAPTACHELMNA
SCHEMBL16798708 0.76 ALDH3A1 (1.00) ALDH1A1ALDH3A1CA12CA1CA2

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
US-5585378-A Composition containing an oxoindole compound AKTIEBOLAGET ASTRA (SE) 1996-12-17 — — US disclosed
EP-0624156-A1 ISATIN DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Astra Aktiebolag (SE) 1994-11-17 — — EP disclosed
WO-1993012085-A1 ISATIN DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AKTIEBOLAGET ASTRA (SE) 1993-06-24 — — WO disclosed
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