SCHEMBL10147512

SCHEMBL10147512

CC(C)(Sc1ccc(C(F)(F)F)cc1)c1nc(C2CCCCC2)no1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TRPV1 Q8NER1 2/20 0.35
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
HDAC5 Q9UQL6 2/20 0.33

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
SCHEMBL352090 0.77 KMT2A (0.47) KMT2ALMNAPOLBCASP3SENP7
SCHEMBL10147504 0.76 LMNA (0.34) LMNAPOLBKDM4ENPC1RAB9A
SCHEMBL24752179 0.74 POLB (0.44) KMT2ALMNAPOLBCASP3SENP7
SCHEMBL24753886 0.74 POLB (0.44) KMT2ALMNAPOLBCASP3SENP7
SCHEMBL8252792 0.74 POLB (0.46) POLBCASP3SENP7SENP6KDM4E
SCHEMBL10147515 0.71 POLB (0.39) KMT2APOLBCASP3SENP7SENP6
SCHEMBL10146061 0.71 POLB (0.46) KMT2APOLBCASP3SENP7SENP6
SCHEMBL21397907 0.70 POLB (0.44) POLBCASP3SENP7SENP6KDM4E
SCHEMBL13618543 0.69 POLB (0.44) KMT2APOLBCASP3SENP7SENP6
SCHEMBL21397910 0.67 POLB (0.40) POLBCASP3SENP7SENP6KDM4E

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-2418207-A1 Sulfone compounds which modulate the CB2 receptor Boehringer Ingelheim International GmbH (DE) 2012-02-15 EP disclosed