SCHEMBL25818159

SCHEMBL25818159

CC1(OC(=O)COc2ccc([SH]3CCCCC3)cc2)C2CC3CC(C2)CC1C3

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.42
CYP19A1 P11511 2/20 0.42
EPHX2 P34913 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD11B1 P28845 1/20 0.34
GLA P06280 1/20 0.34
CASP2 P42575 1/20 0.34
LMNA P02545 2/20 0.33
GAA P10253 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
SCHEMBL25818120 0.99 CYP17A1 (0.43) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL16406651 0.82 LMNA (0.50) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL10299077 0.82 GAA (0.50) CYP17A1CYP19A1RAB9AKMT2AHSD11B1
SCHEMBL12997500 0.81 CYP17A1 (0.46) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL16429454 0.81 CYP17A1 (0.46) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL25818119 0.81 CYP17A1 (0.39) CYP17A1CYP19A1
SCHEMBL16429455 0.81 CYP17A1 (0.47) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL13418069 0.80 CYP17A1 (0.52) CYP17A1CYP19A1MEN1RAB9AKMT2A
SCHEMBL16426157 0.80 CYP17A1 (0.45) CYP17A1CYP19A1EPHX2MEN1RAB9A
SCHEMBL25818154 0.80 CYP19A1 (0.44) CYP19A1RAB9AGLALMNAGAA

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
US-11703756-B2 Resist composition and method of forming resist pattern TOKYO OHKA KOGYO CO., LTD. (JP) 2023-07-18 US disclosed