SCHEMBL4259358

SCHEMBL4259358

OC[C@@H]1C[C@@H](n2ccc3cncnc32)C[C@@H]1O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 2/20 0.38
▸ PRMT5 O14744 2/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ NNMT P40261 1/20 0.36
▸ MKNK2 Q9HBH9 6/20 0.36
▸ UBA6 A0AVT1 4/20 0.34
▸ NAE1 Q13564 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ GRK5 P34947 1/20 0.34
▸ CSNK1A1 P48729 1/20 0.34
▸ NEDD8 Q15843 1/20 0.34
▸ UBA3 Q8TBC4 1/20 0.34
▸ SAE1 Q9UBE0 1/20 0.34
▸ UBA2 Q9UBT2 1/20 0.34
▸ MKNK1 Q9BUB5 1/20 0.33
▸ AHCY P23526 1/20 0.32
▸ ADORA2B P29275 1/20 0.32

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
SCHEMBL14563559 0.83 NAE1 (0.39) PRMT5WDR77NNMTMKNK2UBA6
SCHEMBL937900 0.82 MKNK2 (0.37) PRMT5WDR77NNMTMKNK2UBA6
SCHEMBL937901 0.82 UBA6 (0.49) PRMT5WDR77NNMTMKNK2UBA6
SCHEMBL14563561 0.81 NAE1 (0.53) UBA6NAE1CA2GRK5CSNK1A1
SCHEMBL25049095 0.78 PRMT5 (0.36) PRMT5WDR77NNMTMKNK2
SCHEMBL20916985 0.76 PRMT5 (0.45) PRMT5WDR77
SCHEMBL19563037 0.76 ADK (0.48) PRMT5WDR77AHCYADORA2B
SCHEMBL191943 0.76 ADK (0.48) PRMT5WDR77AHCYADORA2B
SCHEMBL1947419 0.76 UBA6 (0.41) TK1PRMT5WDR77NNMTUBA6
SCHEMBL25048671 0.76 UBA6 (0.42) PRMT5WDR77UBA6NAE1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10745404-B2 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2020-08-18 — — US disclosed
EP-2546256-B1 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARM INC (US) 2019-10-09 — — EP disclosed
EP-2540726-B1 Intermediates for the synthesis of E1 activity activating enzyme inhibitors MILLENNIUM PHARM INC (US) 2019-10-09 — — EP disclosed
EP-2540727-B1 SULFAMOYLATING REAGENT MILLENNIUM PHARM INC (US) 2018-07-25 — — EP disclosed
US-20180079755-A1 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-22 — — US disclosed
US-9802938-B2 Sulfamoylating reagents MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-10-31 — — US disclosed
EP-2178880-B1 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS MILLENNIUM PHARM INC (US) 2017-10-04 — — EP disclosed
US-20150353555-A9 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-12-10 — — US disclosed
US-20150080573-A1 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-03-19 — — US disclosed
US-8933225-B2 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-01-13 — — US disclosed
EP-2546256-A2 Process for the synthesis of intermediates compounds useful for the preparation of E1 activity activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-01-16 — — EP disclosed
EP-2540727-A1 SULFAMOYLATING REAGENT MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-01-02 — — EP disclosed
EP-2540726-A1 Intermediates for the synthesis of E1 activity activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-01-02 — — EP disclosed
US-20090036678-A1 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-02-05 — — 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 (5 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-20150353555-A9 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS SULT1E1, SULT1A1, ALDH18A1 TK1 270/4885PRMT5 525/4885WDR77 1507/4885
US-10745404-B2 Process for the synthesis of E1 activating enzyme inhibitors SULT1E1, SULT1A1, STS TK1 225/4885PRMT5 541/4885WDR77 1826/4885
US-20090036678-A1 Process for the synthesis of E1 activating enzyme inhibitors SULT1E1, SULT1A1, ALDH18A1 TK1 270/4885PRMT5 525/4885WDR77 1507/4885
US-20150080573-A1 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS SULT1E1, SULT1A1, ALDH18A1 TK1 270/4885PRMT5 525/4885WDR77 1507/4885
US-20180079755-A1 PROCESS FOR THE SYNTHESIS OF E1 ACTIVATING ENZYME INHIBITORS SULT1E1, SULT1A1, ALDH18A1 TK1 269/4885PRMT5 539/4885WDR77 1464/4885

“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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