SCHEMBL29422734

SCHEMBL29422734

COC(=O)c1cc(Cl)c(Br)c(OC(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.47
PDK2 Q15119 4/20 0.41
PDK1 Q15118 2/20 0.41
PDK3 Q15120 2/20 0.41
PDK4 Q16654 2/20 0.41
ALPL P05186 2/20 0.41
MRGPRX4 Q96LA9 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 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
SCHEMBL14914823 1.00 NOTUM (0.47) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL25371993 0.85 PDK2 (0.46) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL10322914 0.84 KDM4E (0.46) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL25564366 0.84 NOTUM (0.48) NOTUMPDK2ALPLMRGPRX4CA12
SCHEMBL14915765 0.83 MRGPRX4 (0.44) ALPLMRGPRX4POLB
SCHEMBL20763421 0.83 KMT2A (0.48) NOTUMCA12CA1CA2CA7
SCHEMBL10322996 0.82 ALDH1A1 (0.52) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL14914880 0.82 ALPL (0.43) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL29422733 0.82 ALPL (0.43) NOTUMPDK2PDK1PDK3PDK4
SCHEMBL8336289 0.81 CA1 (0.52) NOTUMPDK2PDK1PDK3PDK4

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
EP-3953351-A1 CONDENSED AZINES FOR EP300 OR CBP MODULATION AND INDICATIONS THEREFOR Plexxikon Inc. (US) 2022-02-16 EP disclosed