SCHEMBL7475462

SCHEMBL7475462

N=C(N)c1ccc(O)c(OCC(=O)Nc2ccc(C(=O)N3CC=CC3)cc2)c1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.81
PRSS1 P07477 6/20 0.81
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL7482442 0.90 F10 (1.00) F10PRSS1KMT2AMAPTALDH1A1
SCHEMBL7471106 0.83 F10 (0.71) F10PRSS1MEN1KMT2AMAPT
SCHEMBL7484452 0.83 F10 (1.00) F10PRSS1MEN1KMT2AMAPT
SCHEMBL7472609 0.78 F10 (0.72) F10PRSS1MEN1KMT2AMAPT
SCHEMBL7479950 0.78 F10 (0.79) F10PRSS1KMT2AMAPTALDH1A1
SCHEMBL7475469 0.76 F10 (0.61) F10PRSS1MEN1KMT2AMAPT
SCHEMBL7473566 0.75 F10 (1.00) F10PRSS1
SCHEMBL7475225 0.73 F10 (1.00) F10PRSS1KMT2AMAPTALDH1A1
SCHEMBL7475473 0.73 F10 (1.00) F10PRSS1KMT2AMAPTALDH1A1
SCHEMBL7471700 0.72 F10 (1.00) F10PRSS1KMT2AMAPTALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183235-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2002-03-06 EP disclosed
WO-2000071510-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2000-11-30 WO disclosed