SCHEMBL9534104

SCHEMBL9534104

COc1ccc(O)c(C2=NN(c3ccc(Cl)cc3)C(=O)C2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.58
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48
APP P05067 1/20 0.46
GAA P10253 3/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
AMY1A P0DUB6 3/20 0.44
MAOA P21397 1/20 0.43
RECQL P46063 1/20 0.43
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL10381797 0.92 MAOB (0.49) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9533087 0.90 MAOB (0.57) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9537036 0.88 MAOB (0.58) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL10381192 0.86 MAOB (0.59) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9535278 0.85 MAOB (0.57) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9536258 0.84 MAOB (0.52) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9533173 0.82 MAOB (0.65) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL10381178 0.81 MAOB (0.55) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL9534595 0.81 MAOB (0.59) MAOBMEN1KMT2AMAPTTDP1
SCHEMBL10381181 0.80 MAOB (0.58) MAOBMEN1KMT2AMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0539372-A1 THERAPEUTIC AGENTS The Boots Company PLC (GB) 1993-05-05 EP disclosed
WO-1991011448-A1 THERAPEUTIC AGENTS THE BOOTS COMPANY PLC (GB) 1991-08-08 WO disclosed
WO-1990001481-A1 THERAPEUTIC AGENTS THE BOOTS COMPANY PLC (GB) 1990-02-22 WO disclosed
EP-0354693-A1 Therapeutic agents The Boots Company PLC (GB) 1990-02-14 EP disclosed