SCHEMBL1080720

SCHEMBL1080720

COc1ccc(C(OC[C@@H]2C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](n3cnc4c(N)ncnc43)O2)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.49
TYMP P19971 4/20 0.48
PRMT5 O14744 2/20 0.41
WDR77 Q9BQA1 2/20 0.41
NT5E P21589 2/20 0.40
AHCY P23526 1/20 0.39
TRDMT1 O14717 1/20 0.39
CARM1 Q86X55 1/20 0.39
BCHE P06276 3/20 0.38

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
SCHEMBL1080722 1.00 ADORA1 (0.49) ADORA1TYMPPRMT5WDR77NT5E
SCHEMBL20305315 0.89 NT5E (0.49) TYMPNT5E
SCHEMBL20333313 0.89 NT5E (0.49) TYMPNT5E
SCHEMBL30115178 0.89 NT5E (0.49) TYMPNT5E
SCHEMBL24191239 0.87 ADORA1 (0.49) ADORA1TYMPNT5ETRDMT1
SCHEMBL1068389 0.86 TYMP (0.55) ADORA1TYMPPRMT5WDR77NT5E
SCHEMBL1068391 0.86 TYMP (0.55) ADORA1TYMPPRMT5WDR77NT5E
SCHEMBL3796369 0.84 ADORA2B (0.44) ADORA1TYMP
SCHEMBL12067762 0.81 BCHE (0.49) ADORA1TYMPPRMT5WDR77NT5E
SCHEMBL28827070 0.81 ADORA1 (0.51) ADORA1TYMPNT5ETRDMT1CARM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011005595-A2 2-5A ANALOGS AND THEIR METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2011-01-13 WO disclosed
US-20100331397-A1 2-5A ANALOGS AND THEIR METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2010-12-30 US disclosed
US-20100331397-A1 2-5A ANALOGS AND THEIR METHODS OF USE ALIOS BIOPHARMA, INC. (US) 2010-12-30 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 (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-20100331397-A1 2-5A ANALOGS AND THEIR METHODS OF USE RNASEL, RNASE1, RNASEH1 ADORA1 2126/4885TYMP 250/4885PRMT5 501/4885

“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.