SCHEMBL6894764

SCHEMBL6894764

CCOC(=O)c1c(C)c(C(=O)O)cn1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.48
BAZ2A Q9UIF9 1/20 0.48
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
TSHR P16473 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40

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
SCHEMBL6779742 0.90 BAZ2B (0.54) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL16416882 0.87 BAZ2B (0.46) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL3561926 0.85 GAA (0.54) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL16416800 0.84 BAZ2B (0.46) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL10046852 0.83 ALDH1A1 (0.54) BAZ2BBAZ2AKMT2AALDH1A1GAA
SCHEMBL7253526 0.80 NOTUM (0.40) USP2KMT2AALDH1A1MAPTESR2
SCHEMBL15100485 0.79 ALDH1A1 (0.50) BAZ2BBAZ2AKMT2AALDH1A1GAA
SCHEMBL21413174 0.78 BAZ2B (0.49) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL16416973 0.77 BAZ2B (0.40) BAZ2BBAZ2AUSP2KMT2AALDH1A1
SCHEMBL17838285 0.75 BAZ2B (0.43) BAZ2BBAZ2AUSP2KMT2AALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6683189-B1 POLYAMIDE-OLIGONUCLEOTIDE CONJUGATES; NETROPSIN AND DISTAMYCIN A SYNTHESIS CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-01-27 US disclosed
US-6545162-B1 Solid phase biosynthesis of viricide antibiotic CALIFORNIA INSTITUTE OF TECHNOLOGY 2003-04-08 US disclosed
EP-0885189-B9 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INST OF TECHN (US) 2003-04-02 EP disclosed
EP-0885189-B1 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INST OF TECHN (US) 2002-08-28 EP disclosed
US-6090947-A Method for the synthesis of pyrrole and imidazole carboxamides on a solid support CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-07-18 US disclosed
EP-0885189-A2 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1998-12-23 EP disclosed
WO-1997030975-A2 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1997-08-28 WO disclosed