SCHEMBL16328855

SCHEMBL16328855

CCCCc1nn(-c2nc(N)nc(-n3nc(CCCC)c(/N=N/c4c(C(=O)OC)c(C)nn4C)c3N)n2)c(N)c1/N=N/c1c(C(=O)OC)cnn1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ GRK6 P43250 1/20 0.30

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
SCHEMBL14765508 0.93 KMT2A (0.34) KMT2AMEN1TSHRGRK6
SCHEMBL9974629 0.88 KMT2A (0.31) KMT2AMEN1TSHR
SCHEMBL14765506 0.87 KMT2A (0.33) KMT2AMEN1TSHR
SCHEMBL14765503 0.87 KMT2A (0.33) KMT2AMEN1TSHR
SCHEMBL14765507 0.86 KMT2A (0.32) KMT2AMEN1TSHR
SCHEMBL14765509 0.86 KMT2A (0.32) KMT2AMEN1TSHR
SCHEMBL14765502 0.85 NPC1 (0.36) KMT2AMEN1TSHR
SCHEMBL16328161 0.85 KMT2A (0.32) KMT2AMEN1TSHR
SCHEMBL10332136 0.85 HPGD (0.31) HPGDGRK6
SCHEMBL12845906 0.83 GABRP (0.38) KMT2AMEN1TSHR

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
US-20110205289-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2011-08-25 — — US disclosed
US-20110050789-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
Send feedback