SCHEMBL4289849

SCHEMBL4289849

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(CN)c(O)ccc3nc2-1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 19/20 0.82
▸ MEN1 O00255 5/20 0.82
▸ KMT2A Q03164 5/20 0.82
▸ SMN1; SMN2 Q16637 5/20 0.82
▸ KDM4E B2RXH2 4/20 0.82
▸ MAPT P10636 3/20 0.82
▸ CASP1 P29466 3/20 0.82
▸ CASP7 P55210 3/20 0.82
▸ HBB P68871 3/20 0.82
▸ USP2 O75604 2/20 0.82
▸ LMNA P02545 2/20 0.82
▸ BRCA1 P38398 2/20 0.82
▸ KEAP1 Q14145 2/20 0.82
▸ NFE2L2 Q16236 2/20 0.82
▸ HIF1A Q16665 2/20 0.82
▸ CYP3A4 P08684 2/20 0.82
▸ SLC22A2 O15244 1/20 0.82
▸ TOP2A P11388 1/20 0.82
▸ TOP2B Q02880 1/20 0.82
▸ SLC47A2 Q86VL8 1/20 0.82

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
SCHEMBL30884751 1.00 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL28046515 0.94 TOP1 (0.80) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27477913 0.93 TOP1 (0.85) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL3376452 0.93 TOP1 (0.85) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27781717 0.93 TOP1 (0.84) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2423989 0.93 TOP1 (0.84) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL3377674 0.92 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL23432496 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27595325 0.91 TOP1 (0.81) TOP1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL27504832 0.91 TOP1 (0.81) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4389752-A1 CAMPTOTHECIN DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Simcere Zaiming Pharmaceutical Co., Ltd. (CN) 2024-06-26 — — EP disclosed
WO-2023020605-A1 CAMPTOTHECIN DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 江苏先声药业有限公司 2023-02-23 — — WO disclosed
EP-4119582-A1 COMBINATION THERAPY INVOLVING ANTIBODIES AGAINST CLAUDIN 18.2 FOR TREATMENT OF CANCER Astellas Pharma Inc. (JP) 2023-01-18 — — EP disclosed
EP-3725810-A1 COMBINATION THERAPY INVOLVING ANTIBODIES AGAINST CLAUDIN 18.2 FOR TREATMENT OF CANCER Astellas Pharma Inc. (JP) 2020-10-21 — — EP disclosed
EP-3670537-A1 THERAPY INVOLVING ANTIBODIES AGAINST CLAUDIN 18.2 FOR TREATMENT OF CANCER Astellas Pharma Inc. (JP) 2020-06-24 — — EP disclosed
WO-2011154574-A1 CAMPTOTHECIN DERIVATIVES AS ANTITUMOURAL AGENTS CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2011-12-15 — — WO disclosed
US-20090285878-A1 Compositions and methods for stabilizing liposomal drug formulations TEKMIRA PHARMACEUTICALS CORPORATION (CA) 2009-11-19 — — US disclosed
WO-2007095389-A2 TREATMENT OF HYPERPROLIFERATIVE DISEASES WITH CAMPTOTHECINE N-OXIDE AND ANALOGS NOVACEA, INC. (US) 2007-08-23 — — WO disclosed
EP-1807051-A2 COMPOSITIONS AND METHODS FOR STABILIZING LIPOSOMAL CAMPTOTHECIN FORMULATIONS Inex Pharmaceuticals Corporation (CA) 2007-07-18 — — EP disclosed
WO-2006052767-A2 COMPOSITIONS AND METHODS FOR STABILIZING LIPOSOMAL CAMPTOTHECIN FORMULATIONS INEX PHARMACEUTICALS CORPORATION (CA) 2006-05-18 — — WO disclosed
EP-0802915-B1 CAMPTOTHECIN DERIVATIVES AND ITS MANUFACTURING METHOD CHONG KUN DANG CORP (KR) 2002-12-04 — — EP disclosed
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