SCHEMBL10912235

SCHEMBL10912235

CCCC(=O)NCCOc1ccc2c(c1)C(=O)N(CCO[N+](=O)[O-])C2=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 1/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ LPAR3 Q9UBY5 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 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
SCHEMBL10911817 0.92 LMNA (0.45) PKMLMNAALDH1A1HPGDKMT2A
SCHEMBL10913473 0.88 PDK2 (0.44) PKMLMNAALDH1A1HPGDHSD17B10
SCHEMBL10911899 0.86 POLB (0.44) PKMLMNAALDH1A1KDM4EHSD17B10
Dimethylamine SCHEMBL10909955 0.83 RAB9A (0.43) LMNAALDH1A1KDM4EHPGDKMT2A
SCHEMBL10914087 0.83 RAB9A (0.43) LMNAALDH1A1KDM4EHPGDKMT2A
Nitric Acid SCHEMBL10909522 0.83 POLB (0.43) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10909553 0.82 POLB (0.45) PKMLMNAALDH1A1KDM4EHSD17B10
Diethylamine SCHEMBL10909563 0.81 RAB9A (0.42) LMNAALDH1A1KDM4EHPGDKMT2A
Diethylamine SCHEMBL10911789 0.81 POLB (0.41) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10912915 0.81 RPS6KA2 (0.47) LMNAALDH1A1KDM4EHPGDHSD17B10

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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