SCHEMBL9804204

SCHEMBL9804204

CCCC(=Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
GRIN2D O15399 1/20 0.50
GRIN3B O60391 1/20 0.50
LMNA P02545 1/20 0.50
CYP2D6 P10635 1/20 0.50
SLC6A2 P23975 1/20 0.50
GRIN1 Q05586 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
GRIN2C Q14957 1/20 0.50
GRIN3A Q8TCU5 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47

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
SCHEMBL9804199 1.00 KMT2A (0.50) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804195 0.87 SOAT2 (0.50) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804189 0.87 SOAT2 (0.50) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804184 0.85 KMT2A (0.53) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804174 0.85 KMT2A (0.53) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804131 0.84 KMT2A (0.52) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804138 0.84 KMT2A (0.52) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804208 0.84 KMT2A (0.52) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804212 0.84 KMT2A (0.52) KMT2AGRIN2DGRIN3BLMNACYP2D6
SCHEMBL9804147 0.84 KMT2A (0.52) KMT2AGRIN2DGRIN3BLMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106573947-B Metal complex MERCK PATENT GMBH (DE) 2019-11-01 CN disclosed
CN-104870458-B Metal complex 默克专利有限公司 2019-02-15 CN disclosed
CN-104520308-B Metal complex 默克专利有限公司 2018-09-28 CN disclosed
CN-104870459-B Metal complex 默克专利有限公司 2018-06-26 CN disclosed
EP-0153616-B1 HEAT-SENSITIVE RECORDING MATERIALS KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-04-03 EP disclosed
US-4652512-A DIAZONIUM COMPOUND KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1987-03-24 US disclosed
EP-0153616-A2 Heat-sensitive recording materials KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-09-04 EP disclosed