SCHEMBL29348235

SCHEMBL29348235

CC(C)n1c(F)cccc1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2B6 P20813 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 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
SCHEMBL12411028 0.76 POLB (0.37) PGRPOLBALDH1A1L3MBTL1CDK4
SCHEMBL2741639 0.74 POLB (0.36) PGRPOLBALDH1A1L3MBTL1CDK4
SCHEMBL27407441 0.74 POLB (0.40) PGRPOLBALDH1A1L3MBTL1CDK4
SCHEMBL11920593 0.74 POLB (0.36) PGRPOLBALDH1A1L3MBTL1CDK4
SCHEMBL9354143 0.68 IDH1 (0.37) POLBALDH1A1CYP3A4
SCHEMBL21948296 0.68 LMNA (0.34) PGRPOLBALDH1A1L3MBTL1
SCHEMBL21476005 0.67 POLB (0.33) POLBALDH1A1
SCHEMBL21960472 0.67 ALDH1A1 (0.32) PGRPOLBALDH1A1L3MBTL1
SCHEMBL18804578 0.64 ALDH1A1 (0.36) PGRPOLBALDH1A1L3MBTL1CDK4
SCHEMBL29941410 0.63 CA12 (0.57) POLBALDH1A1L3MBTL1CDK4CCND1

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed