SCHEMBL6420131

SCHEMBL6420131

COC(=O)c1cc(Cl)ccc1C/C(C)=C/O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.49
NR4A2 P43354 2/20 0.43
HCRTR1 O43613 1/20 0.43
HCRTR2 O43614 1/20 0.43
SLC6A3 Q01959 2/20 0.43
SLC6A4 P31645 1/20 0.43
LMNA P02545 2/20 0.40
ALPL P05186 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CNR1 P21554 1/20 0.38
GAA P10253 1/20 0.38
PLA2G2A P14555 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6420139 1.00 ABL1 (0.49) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL15766352 0.83 ABL1 (0.53) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL10174510 0.81 ABL1 (0.57) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL6420283 0.79 ABL1 (0.49) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL6420281 0.79 ABL1 (0.49) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL29752442 0.78 ABL1 (0.54) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL942693 0.78 ABL1 (0.54) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL8498644 0.78 ABL1 (0.54) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL14466455 0.78 ABL1 (0.50) ABL1NR4A2HCRTR1HCRTR2SLC6A3
SCHEMBL4278401 0.76 ABL1 (0.51) ABL1NR4A2HCRTR1HCRTR2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050227978-A1 Fibrosis inhibitor SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2005-10-13 US disclosed
EP-1479384-A1 FIBROSIS INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-11-24 EP disclosed
US-20040209939-A1 Pyrrole derivatives SUMITOMO PHARMACEUTICALS CO., LTD. 2004-10-21 US 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 (3 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-20050227978-A1 Fibrosis inhibitor SMAD3, MMP1, SMAD2 ABL1 1133/4885NR4A2 268/4885HCRTR1 2788/4885
US-20030181496-A1 Pyrrole derivatives NCOA1, PKD1, NR3C2 ABL1 2293/4885NR4A2 159/4885HCRTR1 1683/4885
US-20040209939-A1 Pyrrole derivatives NCOA1, PKD1, NCOR1 ABL1 2432/4885NR4A2 158/4885HCRTR1 1568/4885

“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.