SCHEMBL529426

SCHEMBL529426

CCS(=O)(=O)N(Cc1ccc(NC(=O)c2ccc(OC(F)(F)F)cc2)cc1)c1ccc(C)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPK1 P28482 1/20 0.55
TRPV1 Q8NER1 4/20 0.50
ABL1 P00519 5/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
GCGR P47871 3/20 0.46
GIPR P48546 2/20 0.46

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
SCHEMBL528857 0.92 SMN1; SMN2 (0.56) LMNASMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL528084 0.92 SMN1; SMN2 (0.56) LMNASMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL528856 0.90 MAPT (0.49) LMNASMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL528120 0.89 LMNA (0.53) LMNASMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL528399 0.89 MAPT (0.56) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL528293 0.88 MAPT (0.59) LMNASMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL528823 0.86 MAPT (0.53) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL529259 0.86 MAPT (0.55) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL528511 0.84 KMT2A (0.52) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL528087 0.84 KMT2A (0.55) LMNASMN1; SMN2MEN1KMT2AMAPT

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
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed