SCHEMBL18572585

SCHEMBL18572585

OCC1C[C@@H](n2ccc3c(Cl)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 1/20 0.52
▸ ADORA2B P29275 1/20 0.52
▸ NNMT P40261 14/20 0.51
▸ PRMT5 O14744 3/20 0.50
▸ WDR77 Q9BQA1 1/20 0.50

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
SCHEMBL9109736 1.00 AHCY (0.52) AHCYADORA2BNNMTPRMT5WDR77
SCHEMBL22002025 1.00 AHCY (0.52) AHCYADORA2BNNMTPRMT5WDR77
SCHEMBL29540101 0.89 NNMT (0.43) AHCYADORA2BNNMTPRMT5WDR77
SCHEMBL22509889 0.89 NNMT (0.43) AHCYADORA2BNNMTPRMT5WDR77
SCHEMBL9469927 0.86 NNMT (0.42) NNMTPRMT5WDR77
SCHEMBL24465141 0.85 PRMT5 (0.67) AHCYADORA2BPRMT5WDR77
SCHEMBL18571689 0.85 PRMT5 (0.67) AHCYADORA2BPRMT5WDR77
SCHEMBL29325375 0.85 PRMT5 (0.67) AHCYADORA2BPRMT5WDR77
SCHEMBL10186262 0.85 AHCY (0.52) AHCYADORA2BPRMT5WDR77
SCHEMBL29323387 0.85 PRMT5 (0.67) AHCYADORA2BPRMT5WDR77

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-20210371433-A1 Novel Monocyclic And Bicyclic Ring System Substituted Carbanucleoside Analogues For Use As PRMT5 Inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 — — US disclosed
US-20210252035-A1 SUBSTITUTED PURINE AND 7-DEAZAPURINE COMPOUNDS Epizyme, Inc. 2021-08-19 — — US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 — — US disclosed
WO-2017032840-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-03-02 — — 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 (3 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-20210371433-A1 Novel Monocyclic And Bicyclic Ring System Substituted Carbanucleoside Analogues For Use As PRMT5 Inhibitors PRMT5, PRMT1, PRMT8 AHCY 1420/4885ADORA2B 1180/4885NNMT 63/4885
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP AHCY 4109/4885ADORA2B 2603/4885NNMT 221/4885
US-20210252035-A1 SUBSTITUTED PURINE AND 7-DEAZAPURINE COMPOUNDS TPMT, DIMT1, DAZAP1 AHCY 117/4885ADORA2B 651/4885NNMT 68/4885

“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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