SCHEMBL25964449

SCHEMBL25964449

CC(C)c1cc(F)c(N2CCC(=O)CC2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.39
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PDE3B Q13370 2/20 0.34
PDE3A Q14432 2/20 0.34
EIF4A3 P38919 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
MAPT P10636 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
ACACB O00763 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
SCHEMBL20883564 0.82 HTR2C (0.34) KMT2AALDH1A1PDE3BPDE3AEIF4A3
SCHEMBL12684538 0.80 ALDH1A1 (0.41) HSD11B1KMT2AALDH1A1PDE3BPDE3A
SCHEMBL16249187 0.80 ALDH1A1 (0.36) KMT2AALDH1A1EIF4A3MAPTGAA
SCHEMBL17543544 0.80 ALDH1A1 (0.42) KMT2AALDH1A1PDE3BPDE3AHTR2C
SCHEMBL14924079 0.79 MAPT (0.42) KMT2AALDH1A1MAPTTRPV4GAA
SCHEMBL20883672 0.77 ALDH1A1 (0.46) ALDH1A1HTR2AHTR2CHTR2BMAPT
SCHEMBL21654083 0.77 GAA (0.41) ALDH1A1EIF4A3GAAALOX15
SCHEMBL16788907 0.77 SLC6A2 (0.37) KMT2AALDH1A1HTR2AMAPTTRPV4
SCHEMBL5622837 0.77 ALDH1A1 (0.41) KMT2AALDH1A1PDE3BPDE3AMAPT
SCHEMBL17543135 0.77 KMT2A (0.41) HSD11B1KMT2AALDH1A1PDE3BPDE3A

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
EP-3421454-B9 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-08-09 EP disclosed