SCHEMBL9689571

SCHEMBL9689571

CCOC(=O)CO/N=C(/C)c1cccc(OC(=O)c2ccc(NC(=N)N)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
MAPT P10636 4/20 0.44
MEN1 O00255 3/20 0.44
PRSS1 P07477 3/20 0.41
ACR P10323 1/20 0.41
F10 P00742 3/20 0.40
F2 P00734 1/20 0.40
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.39
FURIN P09958 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL9689573 1.00 KMT2A (0.44) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9689279 0.92 PRSS1 (0.45) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9689283 0.92 PRSS1 (0.45) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9689734 0.83 KMT2A (0.46) KMT2AMAPTMEN1TSHRSMN1; SMN2
SCHEMBL9689726 0.83 KMT2A (0.46) KMT2AMAPTMEN1TSHRSMN1; SMN2
SCHEMBL9690350 0.83 PRSS1 (0.50) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9690343 0.83 PRSS1 (0.50) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9690288 0.83 PRSS1 (0.42) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL9690295 0.83 PRSS1 (0.42) KMT2AMAPTMEN1PRSS1ACR
SCHEMBL27671252 0.83 MAPT (0.58) KMT2AMAPTMEN1PRSS1ACR

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-0486702-A1 PHENYL 4-GUANIDINOBENZOATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROTEASE INHIBITOR CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-05-27 EP disclosed