SCHEMBL12518136

SCHEMBL12518136

FC(F)CN1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.58
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 5/20 0.45
ANPEP P15144 1/20 0.45
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CYP2A13 Q16696 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KEAP1 Q14145 1/20 0.39
ACHE P22303 1/20 0.39
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ATM Q13315 2/20 0.37
MITF O75030 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 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
SCHEMBL14498526 0.80 USP2 (0.54) USP2KDM4EALDH1A1ANPEPKMT2A
SCHEMBL13274699 0.80 USP2 (0.54) USP2KDM4EALDH1A1ANPEPHSD17B10
SCHEMBL4494214 0.77 USP2 (0.56) USP2KDM4EALDH1A1ANPEPHSD17B10
SCHEMBL4494210 0.77 USP2 (0.50) USP2KDM4EALDH1A1ANPEPHSD17B10
SCHEMBL4501019 0.77 USP2 (0.50) USP2KDM4EALDH1A1ANPEPHSD17B10
SCHEMBL4501023 0.77 USP2 (0.56) USP2KDM4EALDH1A1ANPEPHSD17B10
SCHEMBL3059739 0.75 USP2 (0.54) USP2KDM4EALDH1A1ANPEPKMT2A
SCHEMBL1055186 0.75
SCHEMBL19125455 0.75
SCHEMBL200033 0.74 USP2 (0.58) USP2KDM4EALDH1A1ANPEPKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103282025-B Melt-extruded solid dispersions containing apoptosis-inducing agents 艾伯维爱尔兰无限公司 2018-01-02 CN disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed