SCHEMBL16023740

SCHEMBL16023740

COc1ccc(C(OCC2OC(n3cnc4c(NC(=O)c5ccc(CNC(=O)CCCC(=O)OCC6c7ccccc7-c7ccccc76)cc5)ncnc43)CC2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 2/20 0.43
▸ SLC29A1 Q99808 1/20 0.37
▸ ADORA1 P30542 3/20 0.37
▸ ADORA3 P0DMS8 2/20 0.37
▸ ADORA2B P29275 2/20 0.37

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
SCHEMBL12724727 0.92 TYMP (0.46) TYMPSLC29A1ADORA1
SCHEMBL13930532 0.92 TYMP (0.46) TYMPSLC29A1ADORA1
SCHEMBL13897165 0.92 TYMP (0.46) TYMPSLC29A1ADORA1
SCHEMBL16417871 0.92 TYMP (0.42) TYMPSLC29A1ADORA1ADORA3ADORA2B
SCHEMBL13897137 0.92 TYMP (0.40) TYMPSLC29A1ADORA1ADORA3ADORA2B
SCHEMBL12724731 0.92 TYMP (0.40) TYMPSLC29A1ADORA1ADORA3ADORA2B
SCHEMBL13930543 0.91 TYMP (0.42) TYMPSLC29A1ADORA1ADORA3ADORA2B
SCHEMBL13951916 0.91 TYMP (0.42) TYMPSLC29A1ADORA1ADORA3ADORA2B
SCHEMBL13375793 0.90 ADORA1 (0.36) TYMPADORA1ADORA3ADORA2B
SCHEMBL12724728 0.88 TYMP (0.50) TYMPSLC29A1ADORA1ADORA3ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353142-B2 Protecting group for indole group, nucleic acid-synthesizing amidite and nucleic acid-synthesizing method APTA BIOSCIENCES LTD. (GB) 2016-05-31 — — US disclosed
US-20140256928-A1 PROTECTING GROUP FOR INDOLE GROUP, NUCLEIC ACID-SYNTHESIZING AMIDITE AND NUCLEIC ACID-SYNTHESIZING METHOD APTA BIOSCIENCES LTD. (GB) 2014-09-11 — — 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-20140256928-A1 PROTECTING GROUP FOR INDOLE GROUP, NUCLEIC ACID-SYNTHESIZING AMIDITE AND NUCLEIC ACID-SYNTHESIZING METHOD INMT, NSUN2, RNMT TYMP 464/4885SLC29A1 447/4885ADORA1 555/4885

“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.

Send feedback