SCHEMBL4932010

SCHEMBL4932010

Oc1cc(O)c(-c2noc3ccccc23)cc1CNc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ESR1 P03372 6/20 0.44
ESR2 Q92731 6/20 0.44
HSP90AA1 P07900 3/20 0.43
HSP90AB1 P08238 1/20 0.43
PLA2G1B P04054 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
MAOB P27338 3/20 0.39
TP53 P04637 1/20 0.39
LMNA P02545 1/20 0.37
RAB9A P51151 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
SCHEMBL4928567 0.86 ESR1 (0.50) MAPTMEN1KMT2AL3MBTL1ESR1
SCHEMBL4928618 0.84 MAPT (0.54) MAPTL3MBTL1ESR1ESR2HSP90AA1
SCHEMBL4934925 0.82 MAPT (0.41) MAPTMEN1KMT2AATML3MBTL1
SCHEMBL4935041 0.81 MAPT (0.51) MAPTKMT2AL3MBTL1ESR1ESR2
SCHEMBL4932865 0.74 MAPT (0.50) MAPTMEN1KMT2AL3MBTL1ESR1
SCHEMBL4932005 0.73 ESR1 (0.56) ESR1ESR2HSP90AA1LMNAGAA
SCHEMBL5992116 0.70 ESR1 (0.59) MAPTMEN1KMT2AESR1ESR2
SCHEMBL4933001 0.70 ESR1 (0.52) ESR1ESR2HSP90AA1HSP90AB1
SCHEMBL4933040 0.68 ESR1 (0.44) MAPTKMT2AESR1ESR2HSP90AA1
SCHEMBL4933035 0.68 ESR1 (0.44) MAPTKMT2AESR1ESR2HSP90AA1

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 MAPT 4708/4885MEN1 3102/4885KMT2A 2264/4885

“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.