SCHEMBL29934141

SCHEMBL29934141

O=C(O)c1cncc(OC2CCC(F)(F)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
DDO Q99489 1/20 0.41
LNPEP Q9UIQ6 1/20 0.41
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
HSD17B10 Q99714 1/20 0.41
OPRK1 P41145 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAP4K4 O95819 1/20 0.39
ABHD6 Q9BV23 2/20 0.38
POLB P06746 1/20 0.38
SCD O00767 4/20 0.38
CLK2 P49760 1/20 0.37
CLK3 P49761 1/20 0.37
DYRK1A Q13627 1/20 0.37

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
SCHEMBL23501660 1.00 HCAR2 (0.41) HCAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL29933977 0.86 HCAR2 (0.44) HCAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL23501647 0.86 HCAR2 (0.44) HCAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL23501627 0.85 ATM (0.46) LNPEPOPRK1KCNH2ABHD6CLK2
SCHEMBL31359370 0.85 ATM (0.46) LNPEPOPRK1KCNH2ABHD6CLK2
SCHEMBL3931389 0.82 NPC1 (0.47) HCAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL12168345 0.80 CYP11B1 (0.44) HCAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL25312274 0.79 LNPEP (0.40) KMT2AALDH1A1LMNALNPEPOPRK1
SCHEMBL30507947 0.79 LNPEP (0.40) KMT2AALDH1A1LMNALNPEPOPRK1
SCHEMBL31705286 0.75 CYP11B1 (0.47) HCAR2MEN1KMT2AKDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371371-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2025-01-28 CN disclosed
CN-115315421-B Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2024-12-03 CN disclosed
CN-115315421-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2022-11-08 CN disclosed