SCHEMBL5700705

SCHEMBL5700705

Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.Cc1cc2ccccc2n1C.OB(O)F.OB(O)F.OB(O)F.OB(O)F.OB(O)F.OB(O)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.47
MCL1 Q07820 1/20 0.47
KMT2A Q03164 3/20 0.46
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.45
TP53 P04637 2/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SLC9A1 P19634 1/20 0.41

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
SCHEMBL1172147 1.00 DAO (0.47) DAOMCL1KMT2AMAPTALDH1A1
SCHEMBL29378766 0.88 KMT2A (0.55) DAOMCL1KMT2AMAPTALDH1A1
SCHEMBL154592 0.88 KMT2A (0.55) DAOMCL1KMT2AMAPTALDH1A1
Ammonia Solution, Strong SCHEMBL28142197 0.86 KMT2A (0.53) DAOMCL1KMT2AMAPTALDH1A1
SCHEMBL29528615 0.85 KMT2A (0.53) DAOMCL1KMT2AMAPTALDH1A1
SCHEMBL1172151 0.85 KMT2A (0.53) DAOMCL1KMT2AMAPTALDH1A1
SCHEMBL5700702 0.85 KMT2A (0.53) DAOMCL1KMT2AMAPTALDH1A1
Cyanide SCHEMBL6526282 0.82 KMT2A (0.50) DAOMCL1KMT2AMAPTALDH1A1
Formamide SCHEMBL29013060 0.80 DAO (0.46) DAOMCL1KMT2AMAPTALDH1A1
Formamide SCHEMBL8533326 0.78 DAO (0.47) DAOMCL1KMT2AMAPTALDH1A1

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
US-20060192819-A1 Recording apparatus FUJI XEROX CO., LTD. 2006-08-31 US disclosed
EP-1695829-A2 Recording apparatus with ionic ink or ionic sealing liquid FUJI XEROX CO., LTD. (JP) 2006-08-30 EP disclosed
EP-1676894-A1 Ink, ink set, processing solution, recording method, recording medium, ink tank, and recording device FUJI XEROX CO., LTD. (JP) 2006-07-05 EP disclosed
US-20060139426-A1 Ink, ink set, processing solution, recording method, recording medium, ink tank, and recording device FUJI XEROX CO., LTD. 2006-06-29 US disclosed