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Sugi Predict / Compounds / Teniposide

Teniposide

Teniposide

SCHEMBL4763786

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(CN(C)C)c(O)ccc3nc2-1.CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.COc1cc([C@@H]2c3cc4c(cc3C(O[C@@H]3O[C@@H]5COC(c6cccs6)O[C@H]5[C@H](O)[C@H]3O)C3COC(=O)[C@@H]32)OCO4)cc(OC)c1O.COc1cc([C@@H]2c3cc4c(cc3C(O[C@@H]3O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]3O)C3COC(=O)[C@@H]32)OCO4)cc(OC)c1O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TOP2ATOP2B

The experimentally established mechanism targets of Teniposide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A known ✓ P11388 4/20 0.48
▸ TOP2B known ✓ Q02880 4/20 0.48
▸ GAA P10253 6/20 0.49
▸ CYP3A4 P08684 5/20 0.49
▸ GLA P06280 2/20 0.49
▸ SLC22A2 O15244 2/20 0.49
▸ SLC47A2 Q86VL8 2/20 0.49
▸ SLC47A1 Q96FL8 2/20 0.49
▸ SLC22A1 O15245 1/20 0.49
▸ SLC22A3 O75751 1/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ CHRM4 P08173 1/20 0.49
▸ ADRA2C P18825 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ LMNA P02545 4/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HPGD P15428 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
Irinotecan SCHEMBL17102276 0.95 GAA (0.54) GAACYP3A4GLASLC22A2SLC47A2
Irinotecan SCHEMBL193504 0.91 GAA (0.59) GAACYP3A4GLASLC22A2SLC47A2
Teniposide SCHEMBL5324539 0.91 SMN1; SMN2 (0.58) GAACYP3A4GLASLC22A2SLC47A2
Teniposide SCHEMBL5969910 0.89 SMN1; SMN2 (0.61) GAACYP3A4GLASLC22A2SLC47A2
Etoposide SCHEMBL1276328 0.86 SMN1; SMN2 (0.57) GAACYP3A4GLASLC22A2SLC47A2
Teniposide SCHEMBL2872864 0.85 SMN1; SMN2 (0.56) GAACYP3A4GLASLC22A2SLC47A2
Teniposide SCHEMBL1276780 0.81 GAA (0.66) GAACYP3A4GLASMN1; SMN2LMNA
Teniposide SCHEMBL28858804 0.79 SMN1; SMN2 (0.48) GAACYP3A4GLASLC22A2SLC47A2
Teniposide SCHEMBL8350778 0.78 GAA (0.53) GAACYP3A4GLASMN1; SMN2LMNA
Etoposide SCHEMBL18921683 0.78 GAA (0.61) GAACYP3A4GLASMN1; SMN2LMNA

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
EP-1963321-A2 DIBENZONAPHTHYRIDINE DERIVATIVES AND METHODS OF USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-09-03 — — EP disclosed
WO-2007070319-A2 DIBENZONAPHTHYRIDINE DERIVATIVES AND METHODS OF USE THEREOF WYETH (US) 2007-06-21 — — WO disclosed