SCHEMBL3236248

SCHEMBL3236248

COc1ccc(C=CC(c2ccc(OC)cc2)S(=O)(=O)C(C=Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 3/20 0.49
▸ CYP1B1 Q16678 3/20 0.49
▸ ESR1 P03372 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ PTGS2 P35354 2/20 0.49
▸ AHR P35869 2/20 0.49
▸ TUBB1 Q9H4B7 2/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ TTR P02766 1/20 0.49
▸ ABCB1 P08183 1/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ BCR P11274 1/20 0.49
▸ CYP19A1 P11511 1/20 0.49
▸ NQO2 P16083 1/20 0.49
▸ TUBB4A P04350 1/20 0.49
▸ TUBB P07437 1/20 0.49
▸ TUBA3C P0DPH7 1/20 0.49
▸ TUBA1B P68363 1/20 0.49
▸ TUBA4A P68366 1/20 0.49
▸ TUBB4B P68371 1/20 0.49

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
SCHEMBL3236239 1.00 CYP1A1 (0.49) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL5871380 0.93 APP (0.43) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL3234312 0.93 CYP19A1 (0.50) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL1194745 0.93 NFE2L2 (0.56) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL1195422 0.93 MAOA (0.52) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL3238576 0.93 NFE2L2 (0.56) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL3234318 0.93 CYP19A1 (0.50) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL1195443 0.93 NFE2L2 (0.58) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL3234563 0.93 NFE2L2 (0.58) CYP1A1CYP1B1ESR1CYP1A2PTGS2
SCHEMBL3153066 0.90 CYP1A1 (0.54) CYP1A1CYP1B1ESR1CYP1A2PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735620-B2 Processes for preparing (E)-styrylbenzylsulfone compounds and uses thereof for treating proliferative disorders EPR PHARMACEUTICALS PVT. LTD (IN) 2014-05-27 — — US disclosed
US-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS EPR PHARMACEUTICALS PVT.LTD 2010-06-17 — — 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-20100152491-A1 PROCESSES FOR PREPARING (E)-STYRYLBENZYLSULFONE COMPOUNDS AND USES THEREOF FOR TREATING PROLIFERATIVE DISORDERS PCNA, CDC25B, CCNB1 CYP1A1 2387/4885CYP1B1 939/4885ESR1 1886/4885

“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.

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