SCHEMBL4444370

SCHEMBL4444370

O=C1c2ccccc2C(=O)N1S(=O)(=O)C(Cl)(Cl)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.41
CES1 P23141 3/20 0.39
KMT2A Q03164 5/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 4/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CDC25B P30305 1/20 0.39
IDO1 P14902 1/20 0.38
DNMT1 P26358 1/20 0.38
DNMT3L Q9UJW3 1/20 0.38
DNMT3A Q9Y6K1 1/20 0.38
SCN2A Q99250 1/20 0.38
POLB P06746 2/20 0.38
CES2 O00748 1/20 0.37

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
SCHEMBL27588005 0.83 ERCC1 (0.50) CES1KMT2AKDM4EMAPTALDH1A1
SCHEMBL30643544 0.79 CASP1 (0.42) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL8423045 0.79 CASP1 (0.42) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL11627524 0.76 CASP3 (0.45) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL31229117 0.75 CASP3 (0.48) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL8452187 0.75 CASP3 (0.48) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL115715 0.71 CASP3 (0.50) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL1918743 0.71 KMT2A (0.47) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL21034093 0.71 CASP3 (0.45) CASP3CES1KMT2AKDM4EMAPT
SCHEMBL11023526 0.71 KDM4E (0.56) KMT2AKDM4EMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100524019-C Photoetching adhesive composition SUMITOMO CHEMICAL CO (JP) 2009-08-05 CN disclosed
US-20090124599-A1 Fungicidal Mixtures BASF AKTIENGESELLSCHAFT (DE) 2009-05-14 US disclosed
CN-1407404-A Photoetching adhesive composition SUMITOMO CHEMICAL CO (JP) 2003-04-02 CN 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 (1 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-20090124599-A1 Fungicidal Mixtures ERG28, CYP51A1, DPM1 CASP3 142/4885CES1 2032/4885KMT2A 3401/4885

“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.