SCHEMBL15024955

SCHEMBL15024955

O=C(c1ccccc1)c1ccc(SC(Cl)(Cl)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
SRD5A2 P31213 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RAB9A P51151 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 1/20 0.42
ELANE P08246 3/20 0.41

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
SCHEMBL15007037 0.85 ALDH1A1 (0.54) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL21253178 0.85 CYP1A2 (0.46) ALDH1A1L3MBTL1RAB9AMEN1KMT2A
SCHEMBL15006816 0.77 SRD5A2 (0.42) ALDH1A1SRD5A2L3MBTL1LMNAMAPT
SCHEMBL31090730 0.76 ALDH1A1 (0.52) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL6787662 0.74 ALDH1A1 (0.67) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL17828245 0.74 ALDH1A1 (0.67) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL17828242 0.74 ALDH1A1 (0.67) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL6662205 0.73 ALDH1A1 (0.82) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL31040259 0.73 ALDH1A1 (0.93) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL9066312 0.73 ALDH1A1 (0.93) ALDH1A1SRD5A2L3MBTL1ATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9409861-B2 Mercapto benzophenone compounds, compositions and preparation method thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2016-08-09 US disclosed
US-9409861-B2 Mercapto benzophenone compounds, compositions and preparation method thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2016-08-09 US disclosed
US-20150246878-A1 MERCAPTO BENZOPHENONE COMPOUNDS, COMPOSITIONS AND PREPARATION METHOD THEREOF Insight High Technology (Beijing) Co. Ltd. (CN) 2015-09-03 US disclosed
US-20150246878-A1 MERCAPTO BENZOPHENONE COMPOUNDS, COMPOSITIONS AND PREPARATION METHOD THEREOF Insight High Technology (Beijing) Co. Ltd. (CN) 2015-09-03 US disclosed
US-9061979-B2 Mercapto benzophenone compounds, compositions and preparations method thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2015-06-23 US disclosed
US-9061979-B2 Mercapto benzophenone compounds, compositions and preparations method thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2015-06-23 US disclosed
US-20130150479-A1 Mercapto Benzophenone Compounds, Compositions and Preparation Method Thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2013-06-13 US disclosed
US-20130150479-A1 Mercapto Benzophenone Compounds, Compositions and Preparation Method Thereof Insight High Technology (Beijing) Co. Ltd. (CN) 2013-06-13 US 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-20150246878-A1 MERCAPTO BENZOPHENONE COMPOUNDS, COMPOSITIONS AND PREPARATION METHOD THEREOF MIF, TST, BMI1 ALDH1A1 73/4885SRD5A2 1071/4885L3MBTL1 3322/4885
US-20130150479-A1 Mercapto Benzophenone Compounds, Compositions and Preparation Method Thereof MIF, TST, BMI1 ALDH1A1 73/4885SRD5A2 1071/4885L3MBTL1 3322/4885

“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.