SCHEMBL8913079

SCHEMBL8913079

CCc1[c]cccc1-c1ccc(OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.46
ABCB1 P08183 2/20 0.46
BCR P11274 2/20 0.46
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
PTGS2 P35354 1/20 0.40
SYK P43405 1/20 0.38
AURKB Q96GD4 1/20 0.38
INCENP Q9NQS7 1/20 0.38
BACE1 P56817 1/20 0.38
PTPN1 P18031 1/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
QPCT Q16769 1/20 0.37
QPCTL Q9NXS2 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL6568494 0.87 ABL1 (0.44) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL6736553 0.85 ABL1 (0.45) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL3347947 0.81 SYK (0.33) SYKNPC1RAB9AMEN1KMT2A
SCHEMBL1774729 0.80 DPP4 (0.36) PTGS2BACE1HTR7TP53RAB9A
SCHEMBL10700335 0.78 ABL1 (0.44) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL1646823 0.77 ABL1 (0.50) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL1646811 0.77 ABL1 (0.50) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL4561266 0.77 ABL1 (0.50) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL1867724 0.77 ABL1 (0.50) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL6397214 0.77 KIF11 (0.35) NPC1TP53RAB9ASMN1; SMN2TSHR

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-5596083-A CELLULOSE, POLYAMIDES, POLYURETHANES OR LEATHER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-01-21 US disclosed
EP-0719840-A1 Monoazo compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-07-03 EP disclosed