SCHEMBL95775

SCHEMBL95775

C[C](C)Cc1cccc2c1OCO2

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.46
EED O75530 2/20 0.43
KDM4C Q9H3R0 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.41
MT-CO2 P00403 1/20 0.41
LMNA P02545 1/20 0.40
FAAH O00519 1/20 0.40
HTR2A P28223 2/20 0.39
HTR2C P28335 1/20 0.39
MGAM O43451 1/20 0.38
AMY1A P0DUB6 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOB P27338 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
SCHEMBL6998774 0.86 MTNR1A (0.51) MTNR1AEEDKDM4CMT-CO2LMNA
SCHEMBL3402977 0.80 KDM4C (0.50) MTNR1AEEDKDM4CLMNAFAAH
SCHEMBL14665119 0.80 MTNR1A (0.46) MTNR1AEEDKDM4CMT-CO2LMNA
SCHEMBL19772837 0.79 MTNR1A (0.45) MTNR1AEEDKDM4CABCG2LMNA
SCHEMBL28031245 0.79 KDM4C (0.46) MTNR1AEEDKDM4CABCG2MT-CO2
SCHEMBL506237 0.79 EED (0.46) MTNR1AEEDKDM4CABCG2LMNA
SCHEMBL2602430 0.79 EED (0.46) MTNR1AEEDKDM4CABCG2FAAH
SCHEMBL29907252 0.79 EED (0.46) MTNR1AEEDKDM4CABCG2LMNA
SCHEMBL14664161 0.78 MTNR1A (0.44) MTNR1AEEDKDM4CMT-CO2LMNA
SCHEMBL4130192 0.76 KDM4C (0.46) MTNR1AEEDKDM4CABCG2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957073-B1 MEDICINAL DRUG OTSUKA PHARMA CO LTD (JP) 2014-04-23 EP disclosed
EP-2612858-A1 STAT3/5 activation inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-07-10 EP disclosed
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
US-20120322807-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. 2012-12-20 US disclosed
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 US disclosed
US-8263599-B2 STAT3/5 activation inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-09-11 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-20100210661-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-19 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed

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

For each of this compound's patents that has machine-readable text (8 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB MTNR1A 1110/4885EED 4310/4885KDM4C 1847/4885
US-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 MTNR1A 486/4885EED 2637/4885KDM4C 424/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 MTNR1A 460/4885EED 4090/4885KDM4C 4207/4885
US-20120322807-A1 STAT3/5 ACTIVATION INHIBITOR STAT3, JAK2, STAT1 MTNR1A 1008/4885EED 1285/4885KDM4C 1587/4885
US-20100210661-A1 STAT3/5 ACTIVATION INHIBITOR STAT3, JAK2, STAT1 MTNR1A 1065/4885EED 1659/4885KDM4C 1231/4885
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 MTNR1A 560/4885EED 3569/4885KDM4C 1965/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 MTNR1A 460/4885EED 4090/4885KDM4C 4207/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 MTNR1A 225/4885EED 2565/4885KDM4C 368/4885

“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.