SCHEMBL18042134

SCHEMBL18042134

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(N)nc43)[C@H](OC)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 11/20 0.68
▸ HPGD P15428 1/20 0.54
▸ HINT1 P49773 4/20 0.52
▸ TAS1R3 Q7RTX0 1/20 0.52
▸ TAS1R1 Q7RTX1 1/20 0.52
▸ GSK3A P49840 2/20 0.50
▸ RPS6KA3 P51812 2/20 0.50
▸ MAPK14 Q16539 2/20 0.50
▸ NT5E P21589 1/20 0.49

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
SCHEMBL16702978 1.00 TYMP (0.68) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL1738400 1.00 TYMP (0.68) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL21905181 0.94 TYMP (0.67) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL6420722 0.93 TYMP (0.79) TYMPHPGDHINT1GSK3ARPS6KA3
SCHEMBL17223100 0.92 TYMP (0.64) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL6460952 0.91 TYMP (0.63) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL313746 0.90 TYMP (0.62) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL313747 0.90 TYMP (0.62) TYMPHPGDHINT1TAS1R3TAS1R1
SCHEMBL5960204 0.90 TYMP (0.69) TYMPHPGDHINT1GSK3ARPS6KA3
SCHEMBL10433562 0.89 TYMP (0.60) TYMPHPGDHINT1TAS1R3TAS1R1

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
US-20200392498-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS SOLSTICE BIOLOGICS LTD (IE) 2020-12-17 — — US disclosed
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS BRADSHAW CURT W (US) 2017-04-27 — — US disclosed
US-20160257961-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING DISULFIDE GROUPS BRADSHAW CURT W (US) 2016-09-08 — — 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-20200392498-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 TYMP 190/4885HPGD 3516/4885HINT1 1712/4885
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 TYMP 190/4885HPGD 3516/4885HINT1 1712/4885

“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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