SCHEMBL22845698

SCHEMBL22845698

C=C(Cl)C(=O)OCC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.39
ALDH1A1 P00352 4/20 0.38
THRB P10828 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
PKM P14618 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GAA P10253 1/20 0.34
HSD11B1 P28845 2/20 0.34
POLB P06746 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
SCHEMBL76909 0.87 ALDH1A1 (0.40) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL22846179 0.84 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AL3MBTL1MAPT
SCHEMBL12605165 0.80 ALDH1A1 (0.40) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL5607929 0.80 ALDH1A1 (0.44) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL22590271 0.79 ALDH1A1 (0.41) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL6560066 0.79 ALDH1A1 (0.39) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL14917102 0.78 ALDH1A1 (0.38) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL11991799 0.77 ALDH1A1 (0.40) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL5608620 0.77 ALDH1A1 (0.45) SCN9AALDH1A1THRBMEN1KMT2A
SCHEMBL10099510 0.77 ALDH1A1 (0.42) SCN9AALDH1A1THRBMEN1KMT2A

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-20200407477-A1 POLYMER, POSITIVE RESIST COMPOSITION, AND METHOD OF FORMING RESIST PATTERN ZEON CORPORATION (JP) 2020-12-31 US disclosed