SCHEMBL6316762

SCHEMBL6316762

Cc1ccc(S(=O)(=O)Nc2onc(-c3ccccn3)c2C(=O)NCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.48
FPR1 P21462 1/20 0.48
POLB P06746 1/20 0.48
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
EDNRA P25101 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.45
SCN3A Q9NY46 1/20 0.45
HPGDS O60760 2/20 0.44
MAPT P10636 1/20 0.44
EDNRB P24530 1/20 0.44

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
SCHEMBL6323782 0.83 EDNRA (0.48) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL6316498 0.81 GAA (0.43) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL6324589 0.78 EDNRA (0.48) EDNRAEDNRB
SCHEMBL6323274 0.77 KDM4E (0.55) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL6317676 0.76 EDNRA (0.46) KMT2AMEN1EDNRAGAAMAPT
SCHEMBL6319053 0.76 HPGDS (0.54) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL6318626 0.75 SMN1; SMN2 (0.47) POLBALDH1A1GAAHPGDSMAPT
SCHEMBL6315769 0.75 L3MBTL1 (0.42) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL6318435 0.75 KDM4E (0.57) KMT2AMEN1ALDH1A1KDM4ETDP1
SCHEMBL6316237 0.73 HPGDS (0.47) POLBKDM4EGAAHPGDS

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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
US-20050228018-A1 Chemical compounds AVENTIS PHARMACEUTICALS INC. (US) 2005-10-13 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 (2 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 KMT2A 1089/4885FPR1 3551/4885POLB 872/4885
US-20050228018-A1 Chemical compounds CMA1, TPSB2, TPSG1 KMT2A 2305/4885FPR1 163/4885POLB 3914/4885

“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.