SCHEMBL8845748

SCHEMBL8845748

CNC(=O)Oc1cc2c(cc1F)N(CCCCc1ccncc1)CC2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.36
SLC6A4 P31645 1/20 0.36
SIGMAR1 Q99720 3/20 0.35
DRD3 P35462 2/20 0.34
HCRTR2 O43614 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
TP53 P04637 1/20 0.33
ABCB1 P08183 1/20 0.33
MGAT2 Q10469 1/20 0.33
DRD2 P14416 1/20 0.33
AKR1C3 P42330 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8845756 0.84 HTR2C (0.39) HCRTR2HTR2CHTR2B
SCHEMBL8845742 0.73 TP53 (0.35) HCRTR2HTR2CHTR2BTP53MEN1
SCHEMBL8846256 0.70 TP53 (0.43) DRD4SLC6A4HCRTR2TP53MEN1
SCHEMBL8845548 0.70 ACHE (0.51)
SCHEMBL8846262 0.68 ACHE (0.43) HTR2CHTR2BMEN1KMT2A
SCHEMBL8845762 0.67 BCHE (0.47)
SCHEMBL9154489 0.64 EPHX2 (0.44)
SCHEMBL8845543 0.63 PLA2G4A (0.44)
SCHEMBL8845757 0.62 HDAC1 (0.36) TP53MGAT2MEN1KMT2A
SCHEMBL30376267 0.62 HDAC1 (0.47)

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-5688816-A COGNITION ACTIVATOR; ALZHEIMER'S DISEASE HOECHST MARION ROUSSEL, INC. (US) 1997-11-18 US disclosed
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