SCHEMBL26939367

SCHEMBL26939367

CC(C(=O)O)C(=O)OC(C)(C)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
ALOX15 P16050 2/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ALDH1A1 P00352 3/20 0.33
EPHX1 P07099 1/20 0.33
NPC1 O15118 1/20 0.33
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
EPHX2 P34913 1/20 0.32
CA2 P00918 1/20 0.31

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
SCHEMBL2167747 0.87 CA2 (0.40) MEN1MAPK1KMT2AALOX15ALDH1A1
SCHEMBL9608676 0.85 MEN1 (0.36) MEN1MAPK1KMT2AALOX15ALDH1A1
SCHEMBL17577430 0.82 MEN1 (0.35) NPSR1MEN1MAPK1KMT2AALOX15
SCHEMBL26939384 0.82 SMN1; SMN2 (0.35) SMN1; SMN2NPSR1MEN1MAPK1KMT2A
SCHEMBL14539789 0.79 MEN1 (0.33) MEN1MAPK1KMT2AALDH1A1EPHX1
SCHEMBL111708 0.79 ALDH1A1 (0.38) SMN1; SMN2MEN1MAPK1KMT2AALDH1A1
SCHEMBL17049827 0.76 KMT2A (0.41) SMN1; SMN2MEN1MAPK1KMT2AALOX15
SCHEMBL18595654 0.76 ALDH1A1 (0.33) SMN1; SMN2NPSR1MEN1MAPK1KMT2A
SCHEMBL14559854 0.76 PRKCA (0.32) SMN1; SMN2MEN1MAPK1KMT2AALDH1A1
SCHEMBL3290691 0.75 MEN1 (0.39) MEN1MAPK1KMT2AALOX15ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230400766-A1 ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-14 US disclosed
US-20230400766-A1 ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-14 US disclosed