SCHEMBL5150145

SCHEMBL5150145

Cc1cc(NC(=O)O)ccc1Oc1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.50
AR P10275 1/20 0.50
STK39 Q9UEW8 1/20 0.49
DHODH Q02127 1/20 0.46
PNLIP P16233 3/20 0.44
PARG Q86W56 1/20 0.43
MAPK14 Q16539 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN9A Q15858 1/20 0.43
HDAC3 O15379 1/20 0.41
BRAF P15056 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41

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
SCHEMBL5148195 0.91 PNLIP (0.44) PGRARSTK39DHODHPNLIP
SCHEMBL21295412 0.86 STK39 (0.62) PGRARSTK39DHODHPNLIP
SCHEMBL4687674 0.86 RAB9A (0.51) PNLIPALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL5151671 0.84 PNLIP (0.52) PNLIPPARGBRAF
SCHEMBL4686529 0.82 THRA (0.49) ARMAPK14ALDH1A1SMN1; SMN2THRB
SCHEMBL4687070 0.81 MAPT (0.41) PGRARPNLIPMAPK14SCN9A
SCHEMBL28623921 0.81 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2LMNAGAAMAPT
SCHEMBL4228260 0.81 PKM (0.54) PGRARSTK39MAPK14ALDH1A1
SCHEMBL5149569 0.81 TGM2 (0.56) PGRMAPK14HDAC3BRAFHDAC4
SCHEMBL4688637 0.81 MEN1 (0.56) PGRARSTK39LMNAGAA

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-2007071840-A2 COMPOUNDS BASED ON FOUR AROMATIC RINGS, PREPARATION AND USES THEREOF CEREP (FR) 2007-06-28 WO disclosed