SCHEMBL2139128

SCHEMBL2139128

COC(=O)c1c(Cl)cccc1NN

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 5/20 0.47
GAA P10253 3/20 0.47
ALOX5 P09917 1/20 0.46
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NR4A2 P43354 3/20 0.42

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
SCHEMBL9609179 0.84 POLB (0.53) CA12CA1CA2CA7CA9
SCHEMBL517538 0.83 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL2137697 0.80 PBRM1 (0.60) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL28765155 0.79 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL1188368 0.79 CA12 (0.52) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL28022291 0.79 PBRM1 (0.58) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL485070 0.77 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL4627944 0.77 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL29445387 0.77 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL8564502 0.77 CA12 (0.77) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242278-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI (JP) 2012-04-26 US disclosed
EP-1473286-B1 PROCESS FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2009-11-04 EP disclosed
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI 2009-08-27 US disclosed
US-7554000-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-30 US disclosed
CN-1303043-C Process for producing biaryl compound SUMITOMO CHEMICAL CO (JP) 2007-03-07 CN disclosed
CN-1642879-A Process for preparing diaryl compounds SUMITOMO CHEMICAL CO (JP) 2005-07-20 CN disclosed
US-20050096471-A1 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed
EP-1473286-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 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-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR CA12 2549/4885CA1 3383/4885CA2 2297/4885
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR CA12 2549/4885CA1 3383/4885CA2 2297/4885
US-20050096471-A1 Process for producing biaryl compound PPOX, CAT, TYR CA12 2549/4885CA1 3383/4885CA2 2297/4885

“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.