SCHEMBL9154489

SCHEMBL9154489

O=C(NC1CC1c1ccccc1)Oc1ccc2c(c1)CCN2CCCc1ccncc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.44
ACHE P22303 1/20 0.39
KDM1A O60341 7/20 0.38
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
HDAC6 Q9UBN7 3/20 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
SCHEMBL8845762 0.82 BCHE (0.47) EPHX2ACHE
SCHEMBL9154495 0.78 EPHX2 (0.42) EPHX2ACHEKDM1AMAOB
SCHEMBL16494321 0.73 ACHE (0.55) ACHE
SCHEMBL16495028 0.71 ACHE (0.56) EPHX2ACHE
SCHEMBL16494085 0.71 BCHE (0.59) ACHE
SCHEMBL16494711 0.70 ACHE (0.62) EPHX2ACHE
SCHEMBL8845548 0.69 ACHE (0.51) ACHEHDAC6
SCHEMBL16494443 0.69 ACHE (0.60) EPHX2ACHE
SCHEMBL8846256 0.68 TP53 (0.43)
SCHEMBL8846262 0.67 ACHE (0.43) ACHE

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-5455245-A Alzheimer*s disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-10-03 US disclosed
US-5264442-A For treating alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-11-23 US disclosed
EP-0471298-A1 Carbamoyl-1-(pyridinylalkyl)-1H-indoles, indolines and related analogs HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-02-19 EP disclosed