SCHEMBL8220136

SCHEMBL8220136

FC(F)(F)c1cccc(C2CCN(Cc3nc(C4(c5ccccc5)CCCCC4)no3)CC2)n1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 2/20 0.43
DRD4 P21917 11/20 0.42
HTR1A P08908 10/20 0.42
DRD2 P14416 9/20 0.42
KCNH2 Q12809 5/20 0.42
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL8221259 0.99 MEN1 (0.54) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8224487 0.93 KMT2A (0.54) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8220788 0.92 KMT2A (0.64) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8214020 0.92 KMT2A (0.54) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8222201 0.91 KMT2A (0.65) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8220164 0.90 MEN1 (0.54) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8223212 0.90 MEN1 (0.51) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8212358 0.88 KMT2A (0.60) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8213895 0.88 MEN1 (0.49) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL8225204 0.84 MEN1 (0.46) MEN1KMT2AALDH1A1LMNAMAPT

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-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed