SCHEMBL25741024

SCHEMBL25741024

COC(=O)[C@]1(C)CCCC(C)C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 2/20 0.32
USP2 O75604 1/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SOD1 P00441 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 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
SCHEMBL11303192 1.00 CYP1A2 (0.43) CYP1A2NPSR1MAPTMEN1KMT2A
SCHEMBL14218899 0.89 DPP4 (0.35) CYP1A2NPSR1MAPTMEN1KMT2A
SCHEMBL11919623 0.89 DPP4 (0.35) CYP1A2NPSR1MAPTMEN1KMT2A
SCHEMBL11080010 0.81 NPSR1 (0.36) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL11302329 0.81 CYP1A2 (0.44) CYP1A2MAPTMEN1KMT2AALDH1A1
SCHEMBL16790659 0.80 SMN1; SMN2 (0.46) NPSR1MAPTALDH1A1POLBL3MBTL1
SCHEMBL18629006 0.80 NPSR1 (0.35) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL22838077 0.80 NPSR1 (0.35) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL812782 0.80 CYP1A2 (0.42) CYP1A2NPSR1MAPTALDH1A1L3MBTL1
SCHEMBL5418297 0.80 NPSR1 (0.35) NPSR1MAPTMEN1KMT2AALDH1A1

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
WO-2023122581-A2 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2023-06-29 WO disclosed