SCHEMBL197216

SCHEMBL197216

Cc1ccc(S(=O)(=O)Oc2cccc(Cl)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
CYP1A1 P04798 1/20 0.49
MAOB P27338 1/20 0.49
ENPP3 O14638 1/20 0.48
ENPP1 P22413 1/20 0.48
ENPP2 Q13822 1/20 0.48
PGR P06401 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
GPR17 Q13304 2/20 0.47
P2RY2 P41231 1/20 0.46
MAPT P10636 2/20 0.46
ALOX12 P18054 1/20 0.46
GAA P10253 2/20 0.46
G6PD P11413 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ESR1 P03372 1/20 0.46

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
SCHEMBL2238589 0.85 TDP1 (0.66) ALDH1A1LMNACYP1A1MAOBENPP3
SCHEMBL4138555 0.85 HTT (0.61) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL21810507 0.83 KMT2A (0.55) ALDH1A1KMT2AMEN1LMNAENPP3
SCHEMBL6938467 0.82 LMNA (0.58) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL4126727 0.81 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL17287654 0.81 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL6470176 0.81 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL6932664 0.81 MEN1 (0.67) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL5316029 0.81 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL12584886 0.80 TDP1 (0.68) ALDH1A1KMT2AMEN1ENPP3ENPP1

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-8293905-B2 Bipyridine compound, transition metal complex, and method for production of conjugated aromatic compound using the transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-23 US disclosed
US-8088883-B2 Transition metal complex and process for producing conjugated aromatic compound using the transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-03 US disclosed
US-20110046336-A1 TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED 2011-02-24 US disclosed
US-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-22 US disclosed
EP-2192124-A1 TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING CONJUGATED AROMATIC COMPOUND WITH THE TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2010-06-02 EP disclosed
EP-2172470-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2010-04-07 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-20110046336-A1 TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX C9, C5, AP1M1 ALDH1A1 974/4885KMT2A 1269/4885MEN1 463/4885
US-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX C9, C5, AP2M1 ALDH1A1 1092/4885KMT2A 2407/4885MEN1 371/4885

“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.