SCHEMBL22709486

SCHEMBL22709486

O=C1NC2(O)C(=O)c3ccccc3C2(O)N1

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.96
▸ ALDH1A1 P00352 11/20 0.50
▸ HSP90AA1 P07900 1/20 0.50
▸ HSP90AB1 P08238 1/20 0.50
▸ HTT P42858 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ ALPL P05186 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ ALPG P10696 1/20 0.47
▸ MAPT P10636 6/20 0.43
▸ TDP2 O95551 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ TSHR P16473 1/20 0.43

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
SCHEMBL21090322 0.72 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1ALPLGAAALPG
SCHEMBL21090321 0.72 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1L3MBTL1ALPLGAA
SCHEMBL22686671 0.71 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1ALPLGAAALPG
SCHEMBL15642447 0.70 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1HSP90AA1HSP90AB1HTT
SCHEMBL21052432 0.69 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1L3MBTL1ALPLGAA
SCHEMBL16253385 0.69 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1GAAMAPTLMNA
SCHEMBL14580998 0.69 ITGA4 (0.55) SMN1; SMN2ALDH1A1HSP90AA1HSP90AB1KDM4E
SCHEMBL21090323 0.68 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1ALPLGAAALPG
SCHEMBL15642518 0.67 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1HSP90AA1HSP90AB1HTT
SCHEMBL8371904 0.67 ALDH1A1 (1.00) SMN1; SMN2ALDH1A1HSP90AA1HSP90AB1HTT

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-20230201799-A1 Macromolecular compositions comprising indene-derivatives, preparation thereof, and use thereof STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) 2023-06-29 — — US disclosed
US-20230201799-A1 Macromolecular compositions comprising indene-derivatives, preparation thereof, and use thereof STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) 2023-06-29 — — US disclosed
US-20200368721-A1 Macromolecular compositions comprising indene-derivatives, preparation thereof, and use thereof STICHTING VOOR DE TECHNISCHE WETENSCHAPPEN (NL) 2020-11-26 — — US disclosed
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