SCHEMBL409996

SCHEMBL409996

Cc1oc2c(C)c3oc(=O)cc(C)c3cc2c1CO

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.51
ALDH1A1 P00352 7/20 0.51
MAPK1 P28482 3/20 0.51
MAOA P21397 2/20 0.51
MAOB P27338 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP1A2 P05177 1/20 0.51
HTR2C P28335 1/20 0.51
ADORA2A P29274 1/20 0.51
L3MBTL1 Q9Y468 5/20 0.50
HSD17B10 Q99714 4/20 0.48
MAPT P10636 3/20 0.48
UBE2N P61088 1/20 0.48
LMNA P02545 5/20 0.45
HPGD P15428 4/20 0.45
HTT P42858 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MCL1 Q07820 3/20 0.45
TSHR P16473 2/20 0.44
GAA P10253 5/20 0.43

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
SCHEMBL29904481 1.00 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL11435078 0.86 L3MBTL1 (0.57) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL8876625 0.86 MAOA (0.53) KDM4EALDH1A1MAOAMAOBCYP3A4
SCHEMBL29874549 0.85 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL3363862 0.85 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL4374097 0.85 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL410269 0.85 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
SCHEMBL1115777 0.85 KDM4E (0.51) KDM4EALDH1A1MAPK1MAOAMAOB
Hydrochloric Acid SCHEMBL30428272 0.84 KDM4E (0.50) KDM4EALDH1A1MAPK1MAOAMAOB
Hydrochloric Acid SCHEMBL1001446 0.84 KDM4E (0.50) KDM4EALDH1A1MAPK1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309315-B2 Therapy with CD4 binding peptides and radiation GENMAB A/S (DK) 2016-04-12 US claimed
EP-1951303-B1 THERAPY WITH ANTI-CD4 ANTIBODIES AND RADIATION GENMAB AS (DK) 2011-02-02 EP claimed
US-20100015134-A1 Therapy With CD4 Binding Peptides and Radiation GENMAB A/S 2010-01-21 US claimed
EP-1951303-A2 THERAPY WITH CD4 BINDING PEPTIDES AND RADIATION Genmab A/S (DK) 2008-08-06 EP claimed
WO-2007019865-A2 THERAPY WITH CD4 BINDING PEPTIDES AND RADIATION GENMAB A/S (DK) 2007-02-22 WO claimed
US-20060252674-A1 Methods for pretreating a subject with extracorporeal photopheresis THERAKOS, INC. 2006-11-09 US claimed
EP-1674095-A1 Phototherapy compositions OMJ Ireland Limited (PR) 2006-06-28 EP claimed
US-20060134031-A1 Phototherapy compositions and methods MALLINCKRODT ENTERPRISES LLC 2006-06-22 US claimed
US-20040191806-A1 Assays using crosslinkable immobilized nucleic acids HUAN BINGFANG (US) 2004-09-30 US claimed
US-6696246-B1 ALLOWING STRINGENT WASH CONDITIONS REDUCING BACKGROUND SIGNALS WITHOUT LOSS OF HYBRIDS NAXCOR, INC. 2004-02-24 US claimed
US-4791062-A FELINE VIRAL RHINOTRACHEITIS; FUROCOUMARIN INACTIVATED FELINE HERPES VIRUS I DIAMOND SCIENTIFIC CO. (US) 1988-12-13 US claimed
US-4748120-A Photochemical decontamination treatment of whole blood or blood components DIAMOND SCIENTIFIC CO. (US) 1988-05-31 US claimed
US-4727027-A FUROCOUMARIN DERIVATIVE AND ULTRAVIOLET IRRADIATION DIAMOND SCIENTIFIC CO. (US) 1988-02-23 US claimed
US-4599303-A PSORALEN DERIVATIVES HRI ASSOCIATES, INC. (US) 1986-07-08 US claimed
EP-0165313-A4 NUCLEIC ACID HYBRIDIZATION ASSAY. HRI RES INC (US) 1986-05-16 EP claimed
EP-0165313-A1 NUCLEIC ACID HYBRIDIZATION ASSAY. HYDROCARBON RESEARCH INC (US) 1985-12-27 EP claimed
WO-1985002628-A1 NUCLEIC ACID HYBRIDIZATION ASSAY HRI RESEARCH, INC. (US) 1985-06-20 WO claimed
EP-0124363-A2 Photochemical decontamination treatment of whole blood or blood components DIAMOND SCIENTIFIC CO. (US) 1984-11-07 EP claimed
US-4196281-A CROSSLINKING DNA AND RNA TO INTERFERE WITH REPRODUCTION REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1980-04-01 US claimed
US-4124598-A INHIBITORS OF RNA REPLICATION, INACTIVATION OF VIRUSES, PHOTOCHEMO HOFFMANN-LA ROCHE INC. (US) 1978-11-07 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060134031-A1 Phototherapy compositions and methods VCL, TYR, TTPA KDM4E 4478/4885ALDH1A1 1344/4885MAPK1 3586/4885
US-20100015134-A1 Therapy With CD4 Binding Peptides and Radiation CD4, CD74, SELPLG KDM4E 4522/4885ALDH1A1 4414/4885MAPK1 3368/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.