SCHEMBL15660704

SCHEMBL15660704

Cc1c(O)c(=O)ccn1CCCNCc1ccccc1

nearest known ligand 0.88

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.60
▸ TP53 P04637 1/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ APP P05067 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.47
▸ VEGFA P15692 1/20 0.45
▸ EGLN1 Q9GZT9 1/20 0.45
▸ MAOB P27338 3/20 0.44
▸ ACHE P22303 4/20 0.44
▸ MAOA P21397 1/20 0.44
▸ COMT P21964 1/20 0.43
▸ CHRM2 P08172 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
SCHEMBL9515256 0.84 APP (0.53) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL15658806 0.83 CHRM2 (0.52) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL28783695 0.79 SMN1; SMN2 (0.72) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL4951999 0.79 APP (0.49) KDM4ETP53CYP2D6HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL30701773 0.78 SMN1; SMN2 (0.70) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL9350788 0.76 HTT (1.00) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL7152347 0.74 APP (0.58) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL5136933 0.74 APP (0.58) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL9700234 0.74 KDM4E (0.55) KDM4ETP53CYP2D6HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL8136802 0.73 GSR (0.53) KDM4ETP53CYP2D6HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8887805-B2 Compositions and methods related to mitigating aluminum and ferric precipitates in subterranean formations after acidizing operations HALLIBURTON ENERGY SERVICES, INC. (US) 2014-11-18 — — US disclosed
US-20140116696-A1 Compositions And Methods Related To Mitigating Aluminum And Ferric Precipitates In Subterranean Formations After Acidizing Operations HALLIBURTON ENERGY SERVICES, INC. (US) 2014-05-01 — — US disclosed
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