SCHEMBL3142510

SCHEMBL3142510

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(OC[Si](C)(C)C)ccc3nc2-1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 18/20 0.82
▸ MEN1 O00255 3/20 0.76
▸ KMT2A Q03164 3/20 0.76
▸ SMN1; SMN2 Q16637 3/20 0.76
▸ KDM4E B2RXH2 3/20 0.76
▸ ALDH1A1 P00352 3/20 0.76
▸ CYP3A4 P08684 2/20 0.76
▸ HBB P68871 2/20 0.76
▸ CASP1 P29466 1/20 0.76
▸ CASP7 P55210 1/20 0.76
▸ TP53 P04637 2/20 0.73
▸ GLA P06280 2/20 0.73
▸ HPGD P15428 2/20 0.73
▸ STAT6 P42226 1/20 0.73
▸ CHEK1 O14757 1/20 0.73
▸ HDAC3 O15379 1/20 0.73
▸ ABCC4 O15439 1/20 0.73
▸ GMNN O75496 1/20 0.73
▸ LMNA P02545 1/20 0.73
▸ CYP1A2 P05177 1/20 0.73

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
SCHEMBL6830590 0.93 TOP1 (0.85) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27476036 0.92 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8318602 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1035263 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8887416 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL9384862 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL29994505 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL30662065 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL28363378 0.90 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL23964058 0.90 TOP1 (0.79) TOP1MEN1KMT2ASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197279-B1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS INC (US) 2017-01-18 — — EP claimed
EP-2197279-A1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-06-23 — — EP claimed
US-7687497-B2 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-03-30 — — US claimed
WO-2009051578-A1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2009-04-23 — — WO claimed
US-20090099166-A1 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. 2009-04-16 — — US claimed
EP-2197279-B1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS INC (US) 2017-01-18 — — EP disclosed
EP-2197279-A1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-06-23 — — EP disclosed
US-7687497-B2 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-03-30 — — US disclosed
US-7687497-B2 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-03-30 — — US disclosed
WO-2009051578-A1 C10-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2009-04-23 — — WO disclosed
US-20090099166-A1 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. 2009-04-16 — — US disclosed
US-20090099166-A1 C10-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. 2009-04-16 — — 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-20090099166-A1 C10-substituted camptothecin analogs ABCB1, ABCC1, TOP1 TOP1 3/4885MEN1 1708/4885KMT2A 4272/4885

“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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