SCHEMBL31389484

SCHEMBL31389484

CC(C)(C)[Si](C)(C)OC1CC(n2c(C(F)(F)F)nc3ccccc32)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.42
CCR5 P51681 1/20 0.40
MAPK1 P28482 1/20 0.38
PIK3CB P42338 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C9 P11712 3/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.35
TP53 P04637 2/20 0.35
IDH1 O75874 2/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL31389457 0.83 POLB (0.53) CCR5MAPK1ALDH1A1TSHRMAPT
SCHEMBL31389757 0.83 POLB (0.34) FPR2MAPTTP53
SCHEMBL31389529 0.77 CCR5 (0.47) FPR2CCR5MAPK1PIK3CBKDM4E
SCHEMBL13543531 0.74 CCR5 (0.45) FPR2CCR5MAPK1PIK3CBKDM4E
SCHEMBL3524871 0.74 CCR5 (0.45) FPR2CCR5MAPK1PIK3CBKDM4E
SCHEMBL31389921 0.73
SCHEMBL13543532 0.72 CCR5 (0.49) FPR2CCR5CHRM2CHRM1CHRM3
SCHEMBL31389821 0.70 MET (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL31389659 0.70 CHRM2 (0.37) TSHRCHRM2CHRM1CHRM3
SCHEMBL3527138 0.70 CCR5 (0.55) FPR2CCR5CYP2C9CYP1A2CYP2C19

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-2025043225-A2 DEGRADERS OF CYCLIN-DEPENDENT KINASE 2 GENENTECH, INC. (US) 2025-02-27 WO disclosed