SCHEMBL5458724

SCHEMBL5458724

COc1cccc(Cn2cnc3c(Cl)ncnc32)c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.61
SLC29A1 Q99808 1/20 0.59
HPGD P15428 1/20 0.58
ADORA2A P29274 1/20 0.51
ADORA1 P30542 1/20 0.51
FGFR1 P11362 2/20 0.50
FGFR4 P22455 2/20 0.50
TP53 P04637 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
DAPK1 P53355 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
SCHEMBL5465357 0.86 HPGD (0.64) SLC29A1HPGDFGFR1FGFR4HDAC6
SCHEMBL5458583 0.85 HDAC6 (0.49) YTHDC1SLC29A1HPGDADORA2AFGFR1
SCHEMBL5458838 0.84 YTHDC1 (0.76) YTHDC1ADORA2AADORA1TP53RXFP1
SCHEMBL3394076 0.82 HSP90AB1 (0.68) YTHDC1ADORA2AADORA1HDAC6
SCHEMBL11827194 0.81 HDAC6 (0.54) YTHDC1SLC29A1HPGDFGFR1FGFR4
SCHEMBL30984022 0.81 ADORA2A (0.70) HPGDADORA2AFGFR1FGFR4HDAC6
SCHEMBL2980291 0.81 ADORA2A (0.70) HPGDADORA2AFGFR1FGFR4HDAC6
SCHEMBL30910333 0.81 LPO (0.51) YTHDC1SLC29A1FGFR1FGFR4TP53
SCHEMBL29246271 0.81 LPO (0.51) YTHDC1SLC29A1FGFR1FGFR4TP53
SCHEMBL5462823 0.81 HDAC6 (0.53) YTHDC1SLC29A1HPGDFGFR1FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070203159-A1 Purine compounds UNIVERSITETET I OLSO (NO) 2007-08-30 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-20070203159-A1 Purine compounds PNP, UMPS, TYMP YTHDC1 632/4885SLC29A1 17/4885HPGD 2203/4885

“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.