SCHEMBL24693246

SCHEMBL24693246

C=C(CCN(CC)CC)c1c(C)cccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
MC4R P32245 1/20 0.36
SCN4A P35499 1/20 0.36
MC3R P41968 1/20 0.36
HTR3A P46098 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36
SCN3A Q9NY46 1/20 0.36
GAA P10253 1/20 0.35
BLM P54132 1/20 0.35
ACHE P22303 2/20 0.34
TERT O14746 2/20 0.33
CHRM2 P08172 1/20 0.33

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
SCHEMBL14384875 0.76 KDM4E (0.44) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL19604874 0.72 ACHE (0.38) LMNAALDH1A1MAPK1GAAACHE
SCHEMBL15172878 0.70 ACHE (0.46) KMT2AMAPTLMNAALDH1A1GAA
SCHEMBL15172356 0.70 ACHE (0.46) ALDH1A1CYP3A4ACHECES2CES1
SCHEMBL372983 0.69 SIGMAR1 (0.42) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL25360150 0.69 TDP1 (0.50) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL13938566 0.69 ACHE (0.44) LMNAALDH1A1GAAACHECES2
SCHEMBL31093083 0.68 KCNH2 (0.38) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL25934965 0.68 CES2 (0.44) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL19204051 0.68 TSHR (0.43) MEN1KMT2AMAPTLMNAALDH1A1

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
WO-2022256554-A1 FLUORINATED TRYPTAMINE COMPOUNDS, ANALOGUES THEREOF, AND METHODS USING SAME UNIVERSITY OF THE SCIENCES (US) 2022-12-08 WO disclosed