SCHEMBL7024637

SCHEMBL7024637

O=C1NC(=O)c2c1c1c3cc(F)c(F)cc3[nH]c1c1c2c2cc(F)c(F)cc2n1[C@@H]1O[C@H](COCc2ccccc2)C[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 13/20 0.51
CDK4 P11802 4/20 0.38
CCND1 P24385 4/20 0.38
SSTR1 P30872 1/20 0.37
SSTR2 P30874 1/20 0.37
SSTR4 P31391 1/20 0.37
SSTR3 P32745 1/20 0.37
SSTR5 P35346 1/20 0.37
CCNE2 O96020 3/20 0.35
CCNE1 P24864 3/20 0.35
CDK2 P24941 3/20 0.35
PRKACA P17612 3/20 0.35
PRKACG P22612 3/20 0.35
PRKACB P22694 3/20 0.35
PRKCQ Q04759 2/20 0.35
PRKD3 O94806 1/20 0.34
ERBB2 P04626 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34

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
SCHEMBL5870241 0.94 TOP1 (0.51) TOP1CDK4CCND1SSTR1SSTR2
SCHEMBL5869927 0.93 TOP1 (0.55) TOP1CDK4CCND1CCNE2CCNE1
SCHEMBL7031130 0.88 TOP1 (0.54) TOP1CDK4CCND1CCNE2CCNE1
SCHEMBL5870245 0.87 TOP1 (0.51) TOP1CDK4CCND1CCNE2CCNE1
SCHEMBL7865331 0.86 TOP1 (0.38) TOP1SSTR1SSTR2SSTR4SSTR3
SCHEMBL7865328 0.86 TOP1 (0.38) TOP1SSTR1SSTR2SSTR4SSTR3
SCHEMBL5870514 0.86 TOP1 (0.61) TOP1PRKCA
SCHEMBL6724824 0.86 TOP1 (0.61) TOP1PRKCA
SCHEMBL6736290 0.86 TOP1 (0.57) TOP1CDK4CCND1CCNE2CCNE1
SCHEMBL7027394 0.85 TOP1 (0.45) TOP1CDK4CCND1CCNE2CCNE1

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-20030083271-A1 Topoisomerase I selective cytotoxic sugar derivatives of indolopyrrolocarbazoles BRISTOL-MYERS SQUIBB COMPANY 2003-05-01 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-20030083271-A1 Topoisomerase I selective cytotoxic sugar derivatives of indolopyrrolocarbazoles TOP1, TOP2A, TOP2B TOP1 1/4885CDK4 169/4885CCND1 444/4885

“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.