SCHEMBL8570250

SCHEMBL8570250

CCCCCCCC[B-](c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(OC)cc1.CCCC[P+](CCCC)(CCCC)CCCC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.41
MMP13 P45452 8/20 0.39
MMP9 P14780 7/20 0.38
MMP1 P03956 5/20 0.38
ADAM17 P78536 4/20 0.38
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
CNR1 P21554 1/20 0.36
MMP2 P08253 4/20 0.36
MMP3 P08254 2/20 0.36
MMP8 P22894 2/20 0.35
MGLL Q99685 4/20 0.35

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
SCHEMBL8570126 1.00 DNM1 (0.41) DNM1MMP13MMP9MMP1ADAM17
SCHEMBL8570333 0.97 DNM1 (0.41) DNM1MMP13MMP9MMP1ADAM17
SCHEMBL8568586 0.97 DNM1 (0.41) DNM1MMP13MMP9MMP1ADAM17
SCHEMBL8569801 0.94 DNM1 (0.41) DNM1MMP13MMP9MMP1ADAM17
SCHEMBL8573048 0.94 MMP13 (0.40) DNM1MMP13MMP9MMP1ADAM17
SCHEMBL307357 0.91 CNR1 (0.41) MMP13MMP9CNR1MMP2MMP8
SCHEMBL21102044 0.91 CNR1 (0.41) MMP13MMP9CNR1MMP2MMP8
SCHEMBL306975 0.91 CNR1 (0.41) MMP13MMP9CNR1MMP2MMP8
SCHEMBL8571267 0.89 CNR1 (0.37) MMP13MMP9MMP1ADAM17CNR1
SCHEMBL8568929 0.89 CNR1 (0.37) MMP13MMP9MMP1ADAM17CNR1

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-5814427-A RESIN BINDER, FOR REUSE OF WASTE PAPER BANDO CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-29 US disclosed
EP-0678790-A1 DECOLORABLE TONER AND PRODUCTION METHOD THEREFOR BANDO CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-25 EP disclosed