SCHEMBL31073192

SCHEMBL31073192

C[C@H](O[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.42
CYP1A2 P05177 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX5 P09917 1/20 0.32
PYCR1 P32322 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL408604 1.00 APLNR (0.42) APLNRCYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL31042359 1.00 APLNR (0.42) APLNRCYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL7365019 0.82 APLNR (0.46) APLNRCYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL21556841 0.81 APLNR (0.31) APLNR
SCHEMBL26125642 0.81 NPC1 (0.33) APLNRALDH1A1HPGDHSD17B10KDM4E
SCHEMBL26125646 0.81 NPC1 (0.33) APLNRALDH1A1HPGDHSD17B10KDM4E
SCHEMBL3049989 0.81 APLNR (0.39) APLNRCYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL9185287 0.81 ADRA2B (0.38) ALDH1A1CYP2D6
SCHEMBL24010070 0.80 APLNR (0.41) APLNRALDH1A1
SCHEMBL6160560 0.80 APLNR (0.41) APLNRALDH1A1

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-2024173646-A1 CYCLIN-DEPENDENT KINASE DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-08-22 WO disclosed