SCHEMBL8389682

SCHEMBL8389682

CCCCCCCC=CCCCCCCCCC(=O)Nc1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB11 A5LHX3 3/20 1.00
PSMA7 O14818 3/20 1.00
PSMB1 P20618 3/20 1.00
PSMA1 P25786 3/20 1.00
PSMA2 P25787 3/20 1.00
PSMA3 P25788 3/20 1.00
PSMA4 P25789 3/20 1.00
PSMB8 P28062 3/20 1.00
PSMB9 P28065 3/20 1.00
PSMA5 P28066 3/20 1.00
PSMB4 P28070 3/20 1.00
PSMB6 P28072 3/20 1.00
PSMB5 P28074 3/20 1.00
PSMB10 P40306 3/20 1.00
PSMB3 P49720 3/20 1.00
PSMB2 P49721 3/20 1.00
PSMA6 P60900 3/20 1.00
PSMA8 Q8TAA3 3/20 1.00
PSMB7 Q99436 3/20 1.00
CNR1 P21554 10/20 0.87

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
SCHEMBL8589573 1.00 PSMB11 (1.00) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL8589576 1.00 PSMB11 (1.00) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL8390708 0.97 PSMB11 (0.94) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL1395702 0.93 CNR1 (1.00) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL157919 0.93 CNR1 (1.00) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL6705877 0.93 CNR1 (1.00) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL8622052 0.92 PSMB11 (0.85) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL2720795 0.91 PSMB11 (0.83) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL13510734 0.91 PSMB11 (0.83) PSMB11PSMA7PSMB1PSMA1PSMA2
SCHEMBL7264242 0.91 PSMB11 (0.83) PSMB11PSMA7PSMB1PSMA1PSMA2

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-6004899-A SURFACE TREATED WITH SILANE, TITANATE, AND/OR ALUMINUM COUPLING AGENT; PIGMENT; ERASIBILITY MITSUBISHI PAPER MILLS LIMITED (JP) 1999-12-21 US disclosed
EP-0574879-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1997-05-02 EP disclosed
US-5395815-A Phenolic compound electron acceptor; images; contrast; stability MITSUBISHI PAPER MILLS LIMITED (JP) 1995-03-07 US disclosed
EP-0574879-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1993-12-22 EP disclosed