SCHEMBL25844986

SCHEMBL25844986

CC(C)(Br)C(=O)OC12CC3CC(C1)CC(C(=O)OCC(F)(F)CS(=O)(=O)O)(C3)C2

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 2/20 0.32
TP53 P04637 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ABL1 P00519 1/20 0.30
TSHR P16473 1/20 0.30
RIN1 Q13671 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
SCHEMBL25844989 0.90 NPSR1 (0.38) NPSR1ALDH1A1TP53L3MBTL1MEN1
SCHEMBL25844789 0.90 NPSR1 (0.35) NPSR1ALDH1A1
SCHEMBL25844993 0.81 NPSR1 (0.41) NPSR1ALDH1A1TP53L3MBTL1MEN1
SCHEMBL25844991 0.81 NPSR1 (0.34) NPSR1ALDH1A1TP53L3MBTL1MEN1
SCHEMBL25844791 0.80 NPSR1 (0.38) NPSR1
SCHEMBL13485617 0.79 ALDH1A1 (0.48) NPSR1ALDH1A1L3MBTL1LMNASMN1; SMN2
SCHEMBL18785950 0.79 NPSR1 (0.38) NPSR1ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL13485618 0.78 ALDH1A1 (0.42) NPSR1ALDH1A1MEN1KMT2ACYP17A1
SCHEMBL25844956 0.78 CYP17A1 (0.34) CYP17A1CYP19A1
SCHEMBL26437475 0.78 NPSR1 (0.38) NPSR1ALDH1A1L3MBTL1MEN1KMT2A

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