SCHEMBL23423391

SCHEMBL23423391

CCN(C)Cc1ccc(C(=O)OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.56
ALDH1A1 P00352 5/20 0.53
KDM4E B2RXH2 3/20 0.53
NPC1 O15118 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CYP4A11 Q02928 2/20 0.51
RAB9A P51151 2/20 0.50
CYP4F2 P78329 1/20 0.50
MAPT P10636 5/20 0.49
TDP1 Q9NUW8 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL13052122 0.85 ACHE (0.66) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL5068516 0.84 HDAC8 (0.65) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL5067508 0.84 LOXL2 (0.61) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL5776546 0.83 CYP4A11 (0.57) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL24835147 0.83 CYP4A11 (0.57) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL8781971 0.82 LOXL2 (0.59) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL23374683 0.82 LOXL2 (0.51) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL5775042 0.82 LOXL2 (0.56) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL846524 0.82 SIGMAR1 (0.51) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL9639788 0.82 LOXL2 (0.47) LOXL2ALDH1A1KDM4ENPC1SMN1; SMN2

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-2021101919-A1 COMPOUNDS USEFUL AS INHIBITORS OF HELIOS PROTEIN BRISTOL-MYERS SQUIBB COMPANY (US) 2021-05-27 WO disclosed