SCHEMBL8609670

SCHEMBL8609670

S=C(NCc1ccccc1)Nc1ccc(Oc2ccc(NC(=S)NCc3ccccc3)cc2)cc1

nearest known ligand 0.97

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.97
KMT2A Q03164 4/20 0.97
POLB P06746 2/20 0.97
MEN1 O00255 2/20 0.97
MAOB P27338 2/20 0.78
MAOA P21397 1/20 0.75
MAPT P10636 8/20 0.73
ALDH1A1 P00352 5/20 0.73
KDM4E B2RXH2 2/20 0.73
HTT P42858 2/20 0.73
LMNA P02545 2/20 0.73
SMN1; SMN2 Q16637 4/20 0.72
PLA2G1B P04054 1/20 0.72
ATG4B Q9Y4P1 1/20 0.72
NPSR1 Q6W5P4 1/20 0.69
RAB9A P51151 2/20 0.68
NPC1 O15118 1/20 0.66
BLM P54132 1/20 0.64
ALOX12 P18054 2/20 0.64

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
SCHEMBL8612547 0.90 MAOB (0.92) GAAKMT2APOLBMEN1MAOB
SCHEMBL3484442 0.89 KMT2A (0.82) GAAKMT2APOLBMEN1MAOB
SCHEMBL20536913 0.88 MAOB (1.00) GAAKMT2APOLBMEN1MAOB
SCHEMBL1520659 0.86 MAOB (1.00) GAAKMT2APOLBMEN1MAOB
SCHEMBL166487 0.85 MAPT (1.00) GAAKMT2APOLBMEN1MAPT
SCHEMBL8612629 0.85 MAOB (0.83) GAAKMT2APOLBMEN1MAOB
SCHEMBL7019453 0.84 RAB9A (0.77) GAAKMT2APOLBMEN1MAOB
SCHEMBL8616958 0.83 LSS (0.83) GAAKMT2APOLBMEN1MAOB
SCHEMBL18695142 0.82 MAOB (0.77) GAAKMT2APOLBMEN1MAOB
SCHEMBL27497671 0.82 MEN1 (0.85) GAAKMT2APOLBMEN1MAOB

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