SCHEMBL26804255

SCHEMBL26804255

CC(C)COC(=O)C(CC1(F)COC1)N=C(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.41
RAB9A P51151 1/20 0.37
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
CACNA1F O60840 1/20 0.32
CACNA1D Q01668 1/20 0.32
CACNA1S Q13698 1/20 0.32
CACNA1C Q13936 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAOB P27338 1/20 0.31
PLA2G1B P04054 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31

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
SCHEMBL25467872 0.90 AAK1 (0.44) AAK1RAB9AHPGDPOLBMAPT
SCHEMBL26656090 0.84 AAK1 (0.61) AAK1ALDH1A1TSHRADRB2ADRB1
SCHEMBL26804151 0.77 AAK1 (0.40) AAK1RAB9AHPGDPOLBMAPT
SCHEMBL1067557 0.75 AAK1 (0.44) AAK1MAPTALDH1A1TSHRMEN1
SCHEMBL25172732 0.73 AAK1 (0.65) AAK1ALDH1A1TSHRADRB2ADRB1
SCHEMBL25436641 0.71 AAK1 (0.42) AAK1RAB9AHPGDPOLBMAPT
SCHEMBL6093790 0.66 AAK1 (0.41) AAK1POLBMAPTALDH1A1TSHR
SCHEMBL1688571 0.65 AAK1 (0.57) AAK1POLBMAPTALDH1A1TSHR
SCHEMBL11130905 0.65 AAK1 (0.51) AAK1RAB9APOLBMAPTALDH1A1
SCHEMBL5928301 0.65 MEN1 (0.51) AAK1RAB9APOLBMAPTALDH1A1

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-2023220439-A1 COMPOSITIONS USEFUL FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. (US) 2023-11-16 WO disclosed