SCHEMBL21396817

SCHEMBL21396817

CC(=O)C(C)(SCC12CC3CC(CC(C3)C1)C2)S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
EPHX2 P34913 8/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL21398470 0.71 ALDH1A1 (0.41) ALDH1A1HSD17B10MEN1KMT2AEPHX2
SCHEMBL21396922 0.70 EPHX2 (0.41) ALDH1A1HSD17B10MEN1KMT2AEPHX2
SCHEMBL21135981 0.70 ALDH1A1 (0.38) ALDH1A1HSD17B10MEN1KMT2AEPHX2
SCHEMBL21398831 0.69 ALDH1A1 (0.46) ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL23140674 0.66 EPHX2 (0.40) ALDH1A1HSD17B10EPHX2TSHR
SCHEMBL21397017 0.65 GRM2 (0.37) ALDH1A1HSD17B10MEN1KMT2AEPHX2
SCHEMBL15858317 0.65 ALDH1A1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL27437339 0.65 GRM2 (0.45) ALDH1A1HSD17B10MEN1KMT2AEPHX2
SCHEMBL21397010 0.64 MEN1 (0.51) ALDH1A1MEN1KMT2ACYP2D6EPHX2
SCHEMBL13062249 0.64 ALDH1A1 (0.47) ALDH1A1MEN1KMT2A

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-20190294042-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2019-09-26 US disclosed