SCHEMBL25756946

SCHEMBL25756946

CCCc1cnn2ccc(NCC)c(OC)c12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AOC1 P19801 1/20 0.33
AOC3 Q16853 1/20 0.33
FYN P06241 1/20 0.33
DHFR P00374 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL27199662 0.85 ALDH1A1 (0.35) KDM4EALDH1A1LMNAHSD17B10
SCHEMBL25756945 0.82 DHFR (0.38) FYNDHFRKDM4EALDH1A1LMNA
SCHEMBL25756944 0.80 PCSK9 (0.35) KDM4EALDH1A1LMNAHSD17B10
SCHEMBL27199377 0.76 MAPT (0.35) KDM4EALDH1A1LMNAHSD17B10
SCHEMBL27199703 0.71 IRAK4 (0.35) KDM4EALDH1A1LMNAHSD17B10
SCHEMBL30895044 0.70 PCSK9 (0.36) KDM4EALDH1A1
SCHEMBL27199546 0.70 NPBWR1 (0.33) FYNDHFRKDM4EALDH1A1LMNA
SCHEMBL27199460 0.68 ALDH1A1 (0.34) KDM4EALDH1A1LMNAHSD17B10
SCHEMBL24565970 0.66 TLR7 (0.33)
SCHEMBL27199421 0.66 GAA (0.35) KDM4EALDH1A1HSD17B10

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-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed