SCHEMBL8618338

SCHEMBL8618338

O=C(Nc1ccc(NC(=S)NC2CCCCC2)cc1)c1ccc(NC(=S)NC2CCCCC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.75
KMT2A Q03164 6/20 0.75
LMNA P02545 5/20 0.75
MAPT P10636 3/20 0.75
GAA P10253 3/20 0.75
CYP1A2 P05177 2/20 0.72
CYP2C19 P33261 2/20 0.72
CYP2D6 P10635 1/20 0.72
CYP2C9 P11712 1/20 0.72
SMN1; SMN2 Q16637 7/20 0.66
NPSR1 Q6W5P4 1/20 0.66
HTT P42858 2/20 0.65
ALOX12 P18054 1/20 0.64
RAB9A P51151 5/20 0.63
NPC1 O15118 4/20 0.63
POLB P06746 2/20 0.63
CYP3A4 P08684 1/20 0.63
MAPK1 P28482 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
ALDH1A1 P00352 2/20 0.62

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
SCHEMBL28756963 0.87 SMN1; SMN2 (0.83) MEN1KMT2ALMNAMAPTGAA
SCHEMBL13973006 0.81 RAB9A (0.68) MEN1KMT2ALMNAMAPTGAA
SCHEMBL11149053 0.80 SMN1; SMN2 (0.97) MEN1KMT2ALMNAMAPTGAA
SCHEMBL11697622 0.80 NPSR1 (1.00) MEN1KMT2ALMNAMAPTGAA
SCHEMBL3876288 0.80 SMN1; SMN2 (0.71) MEN1KMT2ALMNAMAPTGAA
SCHEMBL5455050 0.79 SMN1; SMN2 (0.88) MEN1KMT2ALMNAMAPTGAA
SCHEMBL31488078 0.79 SMN1; SMN2 (1.00) MEN1KMT2ALMNAMAPTGAA
SCHEMBL11434608 0.79 LMNA (0.65) MEN1KMT2ALMNAMAPTGAA
SCHEMBL23453329 0.78 SMN1; SMN2 (0.69) MEN1KMT2ALMNAMAPTGAA
SCHEMBL28927984 0.78 RAB9A (0.64) MEN1KMT2ALMNACYP1A2CYP2C19

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-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