SCHEMBL1635283

SCHEMBL1635283

COc1cc(OC)c(C=CS(=O)(=O)Nc2ccc(OC)c(-c3c(N)ccc(S(=O)(=O)O)c3N)c2)c(OC)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.41
HSP90AB1 P08238 3/20 0.41
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
PLK1 P53350 4/20 0.35
MET P08581 1/20 0.35
NQO2 P16083 1/20 0.35
FECH P22830 1/20 0.35
CLK3 P49761 1/20 0.35
BRD4 O60885 2/20 0.35
HDAC3 O15379 2/20 0.34
HDAC4 P56524 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC7 Q8WUI4 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC10 Q969S8 2/20 0.34
HDAC11 Q96DB2 2/20 0.34
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC9 Q9UKV0 2/20 0.34

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
SCHEMBL1637098 0.84 CA12 (0.44) LMNAALDH1A1ABCG2CA12CA1
SCHEMBL1637080 0.83 LMNA (0.42) HSP90AA1HSP90AB1LMNAALDH1A1PLK1
SCHEMBL1634431 0.82 SMN1; SMN2 (0.41) LMNAALDH1A1PLK1METNQO2
SCHEMBL1635873 0.81 PLK1 (0.52) HSP90AA1HSP90AB1LMNAALDH1A1PLK1
SCHEMBL1634647 0.79 ALDH1A1 (0.35) HSP90AA1HSP90AB1LMNAALDH1A1PLK1
SCHEMBL826254 0.79 ALDH1A1 (0.47) LMNAALDH1A1PLK1METNQO2
SCHEMBL826253 0.79 ALDH1A1 (0.47) LMNAALDH1A1PLK1METNQO2
SCHEMBL30527938 0.79 ALDH1A1 (0.47) LMNAALDH1A1PLK1METNQO2
SCHEMBL1634107 0.79 LMNA (0.39) HSP90AA1HSP90AB1LMNAALDH1A1PLK1
SCHEMBL1635273 0.76 PTGES2 (0.42) ALDH1A1PTGES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-03-06 US claimed
EP-3138832-A1 SUBSTITUTED PHENOXY- AND PHENYLTHIO- DERIVATIVES FOR TREATING PROLIFERATIVE DISORDERS Temple University - Of The Commonwealth System of Higher Education (US) 2017-03-08 EP disclosed
US-7932242-B2 Anticancer agents; radiation and chemical resistance TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2011-04-26 US disclosed
US-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-03-06 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 (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-20080058290-A1 Substituted Phenoxy-and Phenylthio-Derivatives for Treating Proliferative Disorders PCNA, MKI67, TP53 HSP90AA1 216/4885HSP90AB1 123/4885LMNA 2048/4885

“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.