SCHEMBL23474205

SCHEMBL23474205

CCOC(=O)Cn1ccnc(NCC(F)(F)c2ccc(C)cc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.46
F2 P00734 13/20 0.44
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
PRSS1 P07477 3/20 0.39
F10 P00742 3/20 0.38
PLAT P00750 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL23461135 0.92 F2 (0.48) FPR2F2PRSS1F10PLAT
SCHEMBL5483486 0.84 F2 (0.62) F2PRSS1F10PRSS2PRSS3
SCHEMBL5856832 0.80 F2 (0.59) F2F10
SCHEMBL12670271 0.79 F2 (0.39) FPR2F2F10
SCHEMBL4898740 0.73 F2 (0.63) F2PRSS1F10PLATPRSS2
SCHEMBL23460848 0.73 FPR2 (0.40) FPR2LMNATSHR
SCHEMBL5475081 0.72 KDM4E (0.47) F2PRSS1
SCHEMBL23460615 0.72 F2 (0.61) F2PRSS1F10PLATPRSS2
SCHEMBL5474418 0.71 TLR9 (0.42) FPR2LMNATSHR
SCHEMBL12636573 0.70 FPR2 (0.46) FPR2LMNATSHR

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-2021113686-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2021-06-10 WO disclosed