SCHEMBL8614130

SCHEMBL8614130

O=C(Nc1ccc(NC(=S)NCc2ccccc2)cc1)c1ccc(NC(=S)NCc2ccccc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.71
MAOA P21397 1/20 0.71
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
MAPT P10636 2/20 0.66
NPSR1 Q6W5P4 1/20 0.66
ALDH1A1 P00352 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
GAA P10253 2/20 0.65
POLB P06746 3/20 0.64
RAB9A P51151 2/20 0.64
MITF O75030 1/20 0.63
HPGD P15428 2/20 0.63
HDAC1 Q13547 3/20 0.62
NAMPT P43490 1/20 0.59

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
SCHEMBL28647479 0.89 MAOB (0.73) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL8612547 0.87 MAOB (0.92) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL6816841 0.87 MAOB (0.69) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL1520659 0.84 MAOB (1.00) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL11683179 0.83 MAPT (0.71) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL11682255 0.83 HDAC1 (0.64) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL7165445 0.83 ALDH1A1 (0.68) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL6816461 0.83 ALDH1A1 (0.71) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL8612629 0.82 MAOB (0.83) MAOBMAOAMEN1KMT2AMAPT
SCHEMBL8612020 0.82 ALDH1A1 (0.76) MEN1KMT2AALDH1A1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0611754-B1 Dimerized thiourea derivatives, near-infrared absorbents comprising the same, and heat wave shielding materials comprising the same JUJO PAPER CO LTD (JP) 1998-04-22 EP disclosed
US-5723075-A HEAT RESISTANT ABSORBERS WITH RESINS FOR SHIELDS NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-03-03 US disclosed
EP-0611754-A1 Dimerized thiourea derivatives, near-infrared absorbents comprising the same, and heat wave shielding materials comprising the same NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-08-24 EP disclosed