SCHEMBL27764694

SCHEMBL27764694

CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(O)c(O)cc3nc2-1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 18/20 0.86
▸ MEN1 O00255 4/20 0.80
▸ KMT2A Q03164 4/20 0.80
▸ SMN1; SMN2 Q16637 4/20 0.80
▸ ALDH1A1 P00352 4/20 0.80
▸ KDM4E B2RXH2 3/20 0.80
▸ CYP3A4 P08684 2/20 0.80
▸ HBB P68871 2/20 0.80
▸ DDX5 P17844 1/20 0.80
▸ CASP1 P29466 1/20 0.80
▸ CASP7 P55210 1/20 0.80
▸ GLA P06280 3/20 0.77
▸ TP53 P04637 2/20 0.77
▸ HPGD P15428 2/20 0.77
▸ STAT6 P42226 1/20 0.77
▸ CHEK1 O14757 1/20 0.77
▸ HDAC3 O15379 1/20 0.77
▸ ABCC4 O15439 1/20 0.77
▸ GMNN O75496 1/20 0.77
▸ LMNA P02545 1/20 0.77

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
SCHEMBL3513607 1.00 TOP1 (0.86) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL23929259 0.93 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL16649109 0.93 TOP1 (0.78) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL23963902 0.93 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL16649363 0.91 TOP1 (0.79) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3138027 0.90 TOP1 (0.82) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL18251453 0.90 TOP1 (0.73) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
Hydroxycamptothecin SCHEMBL25875 0.89 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
Hydroxycamptothecin SCHEMBL29350707 0.89 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1
Hydroxycamptothecin SCHEMBL29929278 0.89 TOP1 (1.00) TOP1MEN1KMT2ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104650342-B Highly branched chain polymeric drug precursor and its application 江苏豪森药业集团有限公司 2018-07-10 — — CN disclosed
CN-104650342-A Highly-branched polymerized prodrug, and applications thereof JIANGSU HANSOH PHARMACEUTICAL 2015-05-27 — — CN disclosed
CN-101605539-B Treatment of resistant or refractory cancers with multi-arm polymeric conjugates of 7-ethyl-10-hydroxycamptothecin ENZON PHARMACEUTICALS INC US 2013-01-02 — — CN disclosed
CN-102481364-A Methods of treating HER2 positive cancers with HER2 receptor antagonists in combination with multi-arm polymeric conjugates of 7-ethyl-10-hydroxycamptothecin ENZON PHARMACEUTICALS INC 2012-05-30 — — CN disclosed
CN-101605539-A Multi-arm polymeric conjugate treatment repellence or refractory cancers with 7-ethyl-10-hydroxycamptothecine ENZON PHARMACEUTICALS INC (US) 2009-12-16 — — CN disclosed
CN-101420963-A Multi-arm polymeric conjugates of 7-ethyl-10-hydroxycamptothecin for treatment of breast, colorectal, pancreatic, ovarian and lung cancers ENZON PHARMACEUTICALS INC (US) 2009-04-29 — — CN disclosed
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