SCHEMBL515166

SCHEMBL515166

O=C1CCC2(CCC(=O)N2c2ccc(O)cc2)N1c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
MMP13 P45452 9/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
MAPK1 P28482 2/20 0.39
HSP90AA1 P07900 1/20 0.39
PKM P14618 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MGLL Q99685 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MMP2 P08253 5/20 0.37
MMP3 P08254 5/20 0.37
MMP9 P14780 5/20 0.37
POLB P06746 2/20 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
SCHEMBL10392048 0.93 MMP13 (0.50) KMT2AMMP13ESR1ESR2MAPK1
SCHEMBL9874462 0.90 MMP13 (0.50) KMT2AMMP13ESR1ESR2ALDH1A1
SCHEMBL8722675 0.90 ESR1 (0.44) KMT2AMMP13ESR1ESR2MAPK1
SCHEMBL10391857 0.87 ESR1 (0.41) KMT2AMMP13ESR1MAPK1ALDH1A1
SCHEMBL8722684 0.87 ESR1 (0.47) KMT2AMMP13ESR1ESR2MAPK1
SCHEMBL9773502 0.85 MMP13 (0.38) KMT2AMMP13MAPK1ALDH1A1KDM4E
SCHEMBL10401778 0.81 DDB1 (0.44) KMT2AMMP13MAPK1NPSR1TDP1
SCHEMBL9730839 0.81 MMP13 (0.52) KMT2AMMP13MGLLTDP1ALDH1A1
SCHEMBL9773395 0.80 MMP13 (0.43) MMP13ALDH1A1HPGDMMP2MMP3
SCHEMBL9736118 0.80 CA12 (0.56) KMT2AMMP13NPSR1TDP1ALDH1A1

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120028180-A1 SPIRODILACTAM POLYCARBONATE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2012-02-02 US claimed
EP-0372656-B1 Polymers comprising spirolactam units SHELL INT RESEARCH (NL) 1995-06-07 EP claimed
US-5061780-A Poly(ether-bis-imide-spiro dilactam) polymer SHELL OIL COMPANY (US) 1991-10-29 US claimed
US-4939251-A Novel spirolactones SHELL OIL COMPANY (US) 1990-07-03 US claimed
EP-0372656-A2 Polymers comprising spirolactam units SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-13 EP claimed
US-4889907-A Polymeric polyhyroxy polyether containing 1,6-diazaspiro-[4.4]nonane-2,7-dione units SHELL OIL COMPANY (US) 1989-12-26 US claimed
US-4847388-A Polycyclic unsaturated ethers and esters SHELL OIL COMPANY (US) 1989-07-11 US claimed
US-8361624-B2 Spirodilactam polycarbonate intermediate transfer members XEROX CORPORATION (US) 2013-01-29 US disclosed
US-20120301725-A1 SPIRODILACTAM POLYCARBONATE INTERMEDIATE TRANSFER MEMBERS XEROX CORPORATION (US) 2012-11-29 US disclosed
US-8304152-B2 Spirodilactam polycarbonate containing photoconductors XEROX CORPORATION (US) 2012-11-06 US disclosed
US-20120028180-A1 SPIRODILACTAM POLYCARBONATE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2012-02-02 US disclosed
US-8071710-B2 Thermoplastic polyphenoxyquinoxaline and method of preparing the same THE UNIVERSITY OF AKRON (US) 2011-12-06 US disclosed
EP-0443688-B1 Spirodilactam-arylsulfone oligomers SHELL INT RESEARCH (NL) 1998-05-06 EP disclosed
US-4906725-A Polycarbonate containing spiro dilactam segment SHELL OIL COMPANY (US) 1990-03-06 US disclosed
US-4895942-A Novel epoxy compounds SHELL OIL COMPANY (US) 1990-01-23 US disclosed
US-4889907-A Polymeric polyhyroxy polyether containing 1,6-diazaspiro-[4.4]nonane-2,7-dione units SHELL OIL COMPANY (US) 1989-12-26 US disclosed
US-4888408-A Polymeric polyhydroxy polyether containing 1,6-diazaspiro-[4.4]nonane-2,7-dione units SHELL OIL COMPANY (US) 1989-12-19 US disclosed
US-4886863-A Novel alkenylphenol derivatives SHELL OIL COMPANY (US) 1989-12-12 US disclosed
EP-0336475-A1 1,6-diazaspiro (4,4)nonane-2,7-dione derivatives SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-10-11 EP disclosed
US-4847388-A Polycyclic unsaturated ethers and esters SHELL OIL COMPANY (US) 1989-07-11 US disclosed