SCHEMBL1637080

SCHEMBL1637080

COc1cc(OC)c(C=CS(=O)(=O)Nc2ccc(OC)c(-c3cc(OC)ccc3S(=O)(=O)O)c2)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HSP90AA1 P07900 2/20 0.40
HSP90AB1 P08238 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
BRD4 O60885 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39
MET P08581 1/20 0.38
NQO2 P16083 1/20 0.38
FECH P22830 1/20 0.38
CLK3 P49761 1/20 0.38
PLK1 P53350 1/20 0.38
CYP19A1 P11511 1/20 0.38
ALPL P05186 1/20 0.38
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 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
SCHEMBL1634431 0.92 SMN1; SMN2 (0.41) LMNAALDH1A1NPSR1SMN1; SMN2BRD4
SCHEMBL1635283 0.83 HSP90AA1 (0.41) LMNAALDH1A1HSP90AA1HSP90AB1SMN1; SMN2
SCHEMBL1634036 0.82 CA12 (0.50) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1634647 0.80 ALDH1A1 (0.35) LMNAALDH1A1HSP90AA1HSP90AB1BRD4
SCHEMBL1122446 0.79 ALDH1A1 (0.63) LMNAALDH1A1SMN1; SMN2CYP1A1CYP1A2
SCHEMBL1634375 0.79 PLK1 (0.56) LMNAALDH1A1SMN1; SMN2CYP1A1CYP1A2
SCHEMBL828283 0.79 NQO2 (0.48) LMNAALDH1A1CYP1A1CYP1B1MET
SCHEMBL828284 0.79 NQO2 (0.48) LMNAALDH1A1CYP1A1CYP1B1MET
SCHEMBL1634613 0.76 ALDH1A1 (0.47) LMNAALDH1A1NPSR1SMN1; SMN2CYP1A1
SCHEMBL1634608 0.76 ALDH1A1 (0.47) LMNAALDH1A1NPSR1SMN1; SMN2CYP1A1

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 LMNA 2048/4885ALDH1A1 564/4885HSP90AA1 216/4885

“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.