SCHEMBL31444429

SCHEMBL31444429

COC(=O)c1cc(F)c(N2CCCC2c2cccc(F)c2Cl)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.43
HSP90AB1 P08238 2/20 0.43
ALOX15 P16050 3/20 0.40
HSD17B10 Q99714 3/20 0.40
ALDH1A1 P00352 5/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPK10 P53779 1/20 0.39
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL31444552 0.81 HDAC6 (0.41) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL31444483 0.80 ALOX15 (0.42) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL31444344 0.76 KMT2A (0.44) ALOX15HSD17B10MAPTKMT2A
SCHEMBL31444296 0.72 TP53 (0.38) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL30989311 0.72 MRGPRX4 (0.49) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL29285091 0.72 MRGPRX4 (0.49) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL12765031 0.70 HSP90AA1 (0.45) HSP90AA1HSP90AB1ALOX15HSD17B10ALDH1A1
SCHEMBL31444386 0.69 SCN9A (0.42) HSP90AA1HSP90AB1ALDH1A1HPGDKDM4E
SCHEMBL16880723 0.68 HSP90AA1 (0.42) HSP90AA1HSP90AB1HSD17B10ALDH1A1HPGD
SCHEMBL31444406 0.67 HDAC6 (0.44) ALDH1A1MAPTRBP4

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-2025072451-A1 RAS-PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNOLOGICAL DISEASES VIVIDION THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed