Exatecan

Exatecan

SCHEMBL29601765

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2C(N)CC3

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TOP1

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

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TOP1 known ✓ P11387 19/20 0.60
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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
Exatecan SCHEMBL7255477 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL29351332 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL31615015 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL23471938 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL2512959 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL25349032 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL7249645 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL26320 1.00 TOP1 (0.60) TOP1MEN1KMT2A
Exatecan SCHEMBL7163616 0.99 TOP1 (0.59) TOP1MEN1KMT2A
Exatecan SCHEMBL6047672 0.99 TOP1 (0.59) TOP1MEN1KMT2A

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
WO-2024008102-A1 LINKER FOR CONJUGATION WUXI XDC (SHANGHAI) CO., LTD. (CN) 2024-01-11 WO disclosed
EP-3997093-A1 PEPTIDE CONJUGATES OF CYTOTOXINS AS THERAPEUTICS Cybrexa 2, Inc. (US) 2022-05-18 EP disclosed