SCHEMBL4932005

SCHEMBL4932005

CCc1cc(-c2noc3ccccc23)c(O)cc1O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.56
ESR2 Q92731 14/20 0.56
HSP90AA1 P07900 6/20 0.46
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
PAX8 Q06710 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL4933001 0.81 ESR1 (0.52) ESR1ESR2HSP90AA1KDM4EFFAR4
SCHEMBL4928567 0.79 ESR1 (0.50) ESR1ESR2HSP90AA1ALOX15ALOX12
SCHEMBL4931003 0.77 ESR1 (0.44) ESR1ESR2KDM4ELMNAFFAR4
SCHEMBL4933522 0.76 ESR1 (0.72) ESR1ESR2HSP90AA1
SCHEMBL4928618 0.76 MAPT (0.54) ESR1ESR2HSP90AA1KDM4EGAA
SCHEMBL4928549 0.74 ESR1 (0.51) ESR1ESR2KDM4ELMNA
SCHEMBL4935041 0.74 MAPT (0.51) ESR1ESR2HSP90AA1ALOX15ALOX12
SCHEMBL4932010 0.73 MAPT (0.48) ESR1ESR2HSP90AA1LMNAGAA
SCHEMBL14261867 0.73 ESR1 (0.72) ESR1ESR2HSP90AA1FFAR4
SCHEMBL14261870 0.72 ESR1 (0.49) ESR1ESR2HSP90AA1ALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070960-A1 Novel 3-Aryl-1,2-Benzisoxazole Derivatives and Use Thereof as Medicinal Products Against Cancer AVENTIS PHARMA S.A. (FR) 2008-03-20 US claimed
US-20080070960-A1 Novel 3-Aryl-1,2-Benzisoxazole Derivatives and Use Thereof as Medicinal Products Against Cancer AVENTIS PHARMA S.A. (FR) 2008-03-20 US disclosed
US-20080070960-A1 Novel 3-Aryl-1,2-Benzisoxazole Derivatives and Use Thereof as Medicinal Products Against Cancer AVENTIS PHARMA S.A. (FR) 2008-03-20 US disclosed
US-20080070960-A1 Novel 3-Aryl-1,2-Benzisoxazole Derivatives and Use Thereof as Medicinal Products Against Cancer AVENTIS PHARMA S.A. (FR) 2008-03-20 US disclosed
EP-1861381-A1 NOVEL 3-ARYL-1,2-BENZISOXAZOLE DERIVATIVES, COMPOSTIONS CONTAINING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2007-12-05 EP disclosed
WO-2006090052-A1 NOVEL 3-ARYL-1,2-BENZISOXAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2006-08-31 WO 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-20080070960-A1 Novel 3-Aryl-1,2-Benzisoxazole Derivatives and Use Thereof as Medicinal Products Against Cancer UGT2B7, UGT2B17, CYP4X1 ESR1 2306/4885ESR2 987/4885HSP90AA1 1416/4885

“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.