SCHEMBL742566

SCHEMBL742566

Cc1cc(C)cc(NCC(=O)Nc2c(C)cc(C)cc2C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
MAPT P10636 3/20 0.52
KDM4E B2RXH2 1/20 0.52
HPGD P15428 2/20 0.51
POLB P06746 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 3/20 0.49
ALOX15 P16050 1/20 0.48
TP53 P04637 1/20 0.47
GAA P10253 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RAPGEF4 Q8WZA2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
PKM P14618 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
SCHEMBL7945872 0.89 MAPT (0.52) LMNAMAPTKDM4EHPGDPOLB
SCHEMBL2092062 0.77 LMNA (0.69) LMNAMAPTHPGDPOLBMEN1
SCHEMBL2092059 0.76 LMNA (0.67) LMNAMAPTHPGDPOLBMEN1
SCHEMBL12883186 0.76 TSHR (0.77) LMNAMAPTHPGDPOLBMEN1
SCHEMBL3952909 0.74 ALDH1A1 (0.68) LMNAMAPTHPGDPOLBMEN1
SCHEMBL11578854 0.74 LMNA (0.70) LMNAMAPTHPGDPOLBMEN1
SCHEMBL3899409 0.74 LMNA (0.96) LMNAMAPTHPGDPOLBMEN1
SCHEMBL4214095 0.74 LMNA (0.65) LMNAMAPTHPGDPOLBMEN1
SCHEMBL13603822 0.74 KDM4E (0.45) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL10333606 0.73 POLB (0.64) LMNAMAPTHPGDPOLBMEN1

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-8138356-B2 Chemical inhibitors of inhibitors of differentiation Angiogeney, Inc. (US) 2012-03-20 US disclosed