SCHEMBL25844993

SCHEMBL25844993

CC(C)(Br)C(=O)OC12CC3CC(C1)CC(C(=O)OCCCS(=O)(=O)O)(C3)C2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 3/20 0.32
RXFP1 Q9HBX9 1/20 0.32
ABL1 P00519 1/20 0.31
TSHR P16473 1/20 0.31
RIN1 Q13671 1/20 0.31
TP53 P04637 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL25844796 0.89 NPSR1 (0.41) NPSR1LMNAMEN1KMT2AL3MBTL1
SCHEMBL18775993 0.84 NPSR1 (0.44) NPSR1LMNANPC1RAB9AMEN1
SCHEMBL25844989 0.84 NPSR1 (0.38) NPSR1LMNANPC1RAB9AMEN1
SCHEMBL12376743 0.82 NPSR1 (0.42) NPSR1LMNAMEN1KMT2AL3MBTL1
SCHEMBL10447425 0.82 NPSR1 (0.42) NPSR1LMNAMEN1KMT2AL3MBTL1
SCHEMBL25844986 0.81 NPSR1 (0.35) NPSR1LMNANPC1RAB9AMEN1
SCHEMBL25844991 0.81 NPSR1 (0.34) NPSR1LMNAMEN1KMT2AL3MBTL1
SCHEMBL21281793 0.79 NPSR1 (0.40) NPSR1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18775888 0.78 NPSR1 (0.47) NPSR1LMNANPC1RAB9AMEN1
SCHEMBL10172809 0.78 NPSR1 (0.52) NPSR1LMNANPC1RAB9AMEN1

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-11709426-B2 Resist composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-07-25 US disclosed