SCHEMBL6601905

SCHEMBL6601905

Cc1ccc(C(=O)c2ccc(C)[nH]2)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMBS P08397 1/20 0.50
SPR P35270 1/20 0.40
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
FLT3 P36888 7/20 0.35
PDGFRB P09619 4/20 0.35
PDGFRA P16234 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
KIT P10721 2/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL1664245 0.82
SCHEMBL3164502 0.78 HTT (0.36) HMBSSPRFLT3ALDH1A1LMNA
SCHEMBL3175020 0.77 SPR (0.34) HMBSSPRFLT3
SCHEMBL3551459 0.77 GAA (0.58) HMBSKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL17624955 0.77 ALOX15 (0.42) HMBSHPGDPDGFRBPDGFRAGAA
SCHEMBL18900582 0.77 HMBS (0.42) HMBSSPRKDM4EHPGDHSD17B10
SCHEMBL1126943 0.77 HMBS (0.42) HMBSSPRKDM4EHPGDHSD17B10
SCHEMBL402047 0.73 LMNA (0.51) KDM4EHPGDHSD17B10ALDH1A1LMNA
SCHEMBL13730301 0.69 PTPN1 (0.58) HPGDHSD17B10ALDH1A1LMNAALOX15
SCHEMBL14705586 0.69 IDO1 (0.53) KDM4EALDH1A1LMNAGAASRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150303377-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME U.S. DEPARTMENT OF ENERGY 2015-10-22 US disclosed
US-20150303377-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME U.S. DEPARTMENT OF ENERGY 2015-10-22 US disclosed
US-20150303377-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME U.S. DEPARTMENT OF ENERGY 2015-10-22 US disclosed
EP-2850670-A2 DIPYRRIN BASED MATERIALS FOR PHOTOVOLTAICS The Regents of The University of Michigan (US) 2015-03-25 EP disclosed
EP-2740166-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME University of Southern California (US) 2014-06-11 EP disclosed
US-20140076403-A1 DIPYRIN BASED MATERIALS FOR PHOTOVOLTAICS, COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2014-03-20 US disclosed
US-20140076403-A1 DIPYRIN BASED MATERIALS FOR PHOTOVOLTAICS, COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2014-03-20 US disclosed
US-20140076403-A1 DIPYRIN BASED MATERIALS FOR PHOTOVOLTAICS, COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2014-03-20 US disclosed
WO-2014025435-A2 DIPYRRIN BASED MATERIALS FOR PHOTOVOLTAICS, COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME FORREST STEPHEN R (US) 2014-02-13 WO disclosed
WO-2013066453-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2013-05-10 WO disclosed
EP-1479384-A1 FIBROSIS INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-11-24 EP disclosed
US-6759429-B2 HAVING TRANSFORMING GROWTH FACTOR- BETA INHIBITORY ACTIVITY AND BEING USEFUL AS FIBROSIS INHIBITORS FOR ORGANS OR TISSUES SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2004-07-06 US disclosed
US-20030181496-A1 Pyrrole derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2003-09-25 US disclosed
EP-1310485-A1 PYRROLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-05-14 EP 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 (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-20150303377-A1 COMPOUNDS CAPABLE OF UNDERGOING SYMMETRY BREAKING INTRAMOLECULAR CHARGE TRANSFER IN A POLARIZING MEDIUM AND ORGANIC PHOTOVOLTAIC DEVICES COMPRISING THE SAME CDH1, RABGGTA, PAX3 HMBS 259/4885SPR 1882/4885KDM4E 2861/4885
US-20030181496-A1 Pyrrole derivatives NCOA1, PKD1, NR3C2 HMBS 3763/4885SPR 2361/4885KDM4E 430/4885

“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.