SCHEMBL9685408

SCHEMBL9685408

Nc1c2c(nc3cnccc13)CCCC2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 10/20 0.61
▸ KDM4E B2RXH2 3/20 0.57
▸ BCHE P06276 7/20 0.44
▸ HSD17B10 Q99714 5/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 3/20 0.37
▸ GRIN1 Q05586 2/20 0.37
▸ GRIN2A Q12879 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ CACNB4 O00305 1/20 0.37
▸ CACNA1A O00555 1/20 0.37
▸ SLC22A2 O15244 1/20 0.37
▸ SLC22A1 O15245 1/20 0.37
▸ ABCC4 O15439 1/20 0.37
▸ CACNA1G O43497 1/20 0.37
▸ CACNG3 O60359 1/20 0.37

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
SCHEMBL4495989 0.81 KDM4E (0.82) ACHEKDM4EBCHEHSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL8984092 0.79 KDM4E (0.80) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL9875444 0.76 ACHE (0.62) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL8786616 0.76 KDM4E (0.60) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL9874848 0.76 ACHE (0.64) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL28984972 0.76 ACHE (0.62) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL9876043 0.76 ACHE (0.63) ACHEKDM4EBCHEGRIN1GRIN2A
SCHEMBL9210645 0.76 ACHE (1.00) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL9874322 0.75 ACHE (0.60) ACHEKDM4EBCHEHSD17B10ALDH1A1
SCHEMBL9873371 0.73 ACHE (0.68) ACHEKDM4EBCHEGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4753950-A MEMORY ENHANCEMENT, ALZHEIMER*S DISEASE HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1988-06-28 — — US claimed
EP-0273176-B1 FUSED HETEROCYCLIC TETRAHYDROAMINOQUINOLINOLS AND RELATED COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-06-24 — — EP disclosed
EP-0273176-A2 Fused heterocyclic tetrahydroaminoquinolinols and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-07-06 — — EP disclosed
US-4753950-A MEMORY ENHANCEMENT, ALZHEIMER*S DISEASE HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1988-06-28 — — US disclosed
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