SCHEMBL6100484

SCHEMBL6100484

CC(c1ccccc1)N1C(=O)c2c(c(O)c3c(ncn3Cc3ccccc3)c2O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
ADORA2B P29275 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PDE1A P54750 3/20 0.40
PDE1B Q01064 3/20 0.40
PDE1C Q14123 3/20 0.40
PDE4A P27815 1/20 0.40
PARN O95453 1/20 0.39
CNOT7 Q9UIV1 1/20 0.39
VEGFA P15692 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
PDE2A O00408 2/20 0.38
EGLN3 Q9H6Z9 2/20 0.37
POLB P06746 1/20 0.37
HIF1A Q16665 1/20 0.37
ALDH1A1 P00352 1/20 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
SCHEMBL6101108 0.77 MAPT (0.39) HPGDALDH1A1
SCHEMBL6101116 0.77 MAPT (0.39) HPGDALDH1A1
SCHEMBL4158476 0.76 KDM4E (0.46) HPGDSMN1; SMN2ADORA2BRXFP1PDE4A
SCHEMBL6099895 0.74 MEN1 (0.45) SMN1; SMN2ADORA2BRXFP1PDE4APARN
SCHEMBL6098712 0.73 HSP90AB1 (0.39) HPGDSMN1; SMN2PDE4AALDH1A1
SCHEMBL6101023 0.71 ALDH1A1 (0.42) HPGDSMN1; SMN2ALDH1A1
SCHEMBL4145710 0.70 ALDH1A1 (0.39) HPGDSMN1; SMN2PARNCNOT7ALDH1A1
SCHEMBL6101896 0.70 TSHR (0.52) HPGDSMN1; SMN2ALDH1A1
SCHEMBL6101048 0.68 USP2 (0.39) HPGDALDH1A1
SCHEMBL1947260 0.68 SMN1; SMN2 (0.58) HPGDSMN1; SMN2ADORA2BRXFP1PDE1A

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-20060211724-A1 Hiv integrase inhibitors VERSCHUEREN GASTON W 2006-09-21 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-20060211724-A1 Hiv integrase inhibitors SULT1A1, SULT2A1, SULT1E1 HPGD 347/4885SMN1; SMN2 3615/4885ADORA2B 1235/4885

“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.