SCHEMBL10911693

SCHEMBL10911693

O=C1c2ccc(Cl)cc2C(=O)N1CCO[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ POLB P06746 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ AGTR1 P30556 1/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA4 P22748 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL10909875 0.92 POLB (0.44) ACHEALDH1A1POLBLMNARAB9A
SCHEMBL10913843 0.83 ESR1 (0.48) ALDH1A1POLBLMNAAGTR1KDM4E
SCHEMBL10913972 0.83 ALOX5 (0.56) ACHEPOLBALOX5RAB9AKDM4E
SCHEMBL3774059 0.82 ALDH1A1 (0.52) ALDH1A1LMNAAGTR1RAB9AKMT2A
SCHEMBL10912534 0.78 HPGD (0.49) ACHEALDH1A1POLBKDM4EMEN1
SCHEMBL10953057 0.77 DRD2 (0.45) —
SCHEMBL10912368 0.77 ALDH1A1 (0.41) ALDH1A1POLBRAB9AMEN1KMT2A
Dimethylamine SCHEMBL10909606 0.76 RPS6KA2 (0.51) ALDH1A1POLBLMNAAGTR1RAB9A
SCHEMBL10909593 0.75 KMT2A (0.43) ACHEMEN1KMT2AMAPT
SCHEMBL10909557 0.75 POLB (0.56) ACHEPOLBALOX5CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0171977-A1 Phthalimide derivatives, compositions containing them and a process for preparing them SANKYO COMPANY LIMITED (JP) 1986-02-19 — — EP disclosed
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