SCHEMBL15926352

SCHEMBL15926352

COc1ccc(-c2c(C(F)(F)F)nn3c(=O)cc(CNCOCc4ccc(C(F)(F)F)cc4)[nH]c23)cc1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
KMT2A Q03164 1/20 0.36
ARF6 P62330 1/20 0.35
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
PDE2A O00408 2/20 0.33
TP53 P04637 4/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
BCL9 O00512 1/20 0.33
CTNNB1 P35222 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMPD3 Q9NY59 1/20 0.32
CKS1B P61024 1/20 0.32
SKP2 Q13309 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32

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
SCHEMBL15926362 0.87 AR (0.37) ARF6KCNQ3KCNQ2PDE2A
SCHEMBL1613995 0.84 PDE2A (0.34) MAPTKMT2APDE2ATP53LMNA
SCHEMBL15926318 0.81 MAPK14 (0.32) MAPTARF6KCNQ3KCNQ2
SCHEMBL15926333 0.80 MAPT (0.41) MAPTARF6KCNQ3KCNQ2TP53
SCHEMBL1613466 0.79 AR (0.40) MAPTARF6PDE2ASMN1; SMN2NPC1
SCHEMBL15926314 0.79 KCNQ3 (0.36) MAPTARF6KCNQ3KCNQ2PDE2A
SCHEMBL15926328 0.76 MAPK14 (0.31) MAPT
SCHEMBL1614735 0.76 PLAT (0.33) MAPTKMT2AKCNQ3KCNQ2PDE2A
SCHEMBL1278772 0.75 MAPT (0.43) MAPTARF6KCNQ3KCNQ2TP53
SCHEMBL1614666 0.74 MAPT (0.33) MAPTARF6KCNQ3KCNQ2GABRP

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
US-8796285-B2 Pyrazolo [1,5-a]-pyrimidones derivatives and pharmaceutical compositions and uses thereof HEBEI MEDICAL UNIVERSITY (CN) 2014-08-05 US disclosed