SCHEMBL30142968

SCHEMBL30142968

N#C/N=C(/NCCCCCCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2)ccn1)Nc1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 8/20 0.51
HDAC3 O15379 5/20 0.51
HDAC4 P56524 5/20 0.51
HDAC1 Q13547 5/20 0.51
HDAC7 Q8WUI4 5/20 0.51
HDAC2 Q92769 5/20 0.51
HDAC10 Q969S8 5/20 0.51
HDAC11 Q96DB2 5/20 0.51
HDAC8 Q9BY41 5/20 0.51
HDAC6 Q9UBN7 5/20 0.51
HDAC9 Q9UKV0 5/20 0.51
HDAC5 Q9UQL6 5/20 0.51
PDGFRB P09619 3/20 0.51
KDR P35968 3/20 0.51
ARAF P10398 1/20 0.51
BRAF P15056 1/20 0.51
GSK3B P49841 1/20 0.49
EPHX2 P34913 1/20 0.45
MET P08581 2/20 0.44
KIT P10721 1/20 0.44

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
SCHEMBL28963967 1.00 RAF1 (0.51) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL30142976 0.92 RAF1 (0.55) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943458 0.92 RAF1 (0.55) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943449 0.87 RAF1 (0.70) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28963973 0.87 RAF1 (0.70) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943467 0.83 RAF1 (0.68) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943481 0.82 RAF1 (0.68) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943521 0.81 RAF1 (0.67) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28943464 0.80 RAF1 (0.71) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL30142965 0.76 SMN1; SMN2 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2

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
CN-111848506-B Biphenyl urea compound and pharmaceutical composition, preparation method and application thereof 中国药科大学 2023-01-31 CN disclosed