SCHEMBL7677097

SCHEMBL7677097

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cccc(N)c3nc2-1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 18/20 0.77
▸ KDM4E B2RXH2 4/20 0.77
▸ RAB9A P51151 2/20 0.77
▸ BLM P54132 2/20 0.77
▸ RECQL P46063 2/20 0.77
▸ TDP1 Q9NUW8 2/20 0.77
▸ POLB P06746 1/20 0.77
▸ MAPT P10636 1/20 0.77
▸ ALDH1A1 P00352 4/20 0.75
▸ MEN1 O00255 4/20 0.75
▸ KMT2A Q03164 4/20 0.75
▸ SMN1; SMN2 Q16637 4/20 0.75
▸ GLA P06280 3/20 0.75
▸ TP53 P04637 2/20 0.75
▸ HPGD P15428 2/20 0.75
▸ CYP3A4 P08684 2/20 0.75
▸ HBB P68871 2/20 0.75
▸ STAT6 P42226 1/20 0.75
▸ CHEK1 O14757 1/20 0.75
▸ HDAC3 O15379 1/20 0.75

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
SCHEMBL8324984 0.90 TOP1 (0.78) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL6232779 0.90 TOP1 (0.77) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL27540723 0.90 TOP1 (0.77) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL8486195 0.90 TOP1 (0.76) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL27547279 0.90 TOP1 (0.76) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL7263268 0.90 TOP1 (0.75) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL7627096 0.90 TOP1 (0.75) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL6849474 0.88 TOP1 (0.78) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL7626519 0.88 TOP1 (0.72) TOP1KDM4ERAB9ABLMRECQL
SCHEMBL7635279 0.88 TOP1 (0.72) TOP1KDM4ERAB9ABLMRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101376659-A Method for purifying camptothecine and derivative thereof SHANGHAI NORTHCAROLINA CHEMLAB (CN) 2009-03-04 — — CN claimed
CN-101376659-B Method for purifying camptothecine and derivative thereof SHANGHAI BIOCOMPOUNDS CHEMLAB CO., LTD. (CN) 2011-11-30 — — CN disclosed
CN-101376659-A Method for purifying camptothecine and derivative thereof SHANGHAI NORTHCAROLINA CHEMLAB (CN) 2009-03-04 — — CN disclosed
US-6403603-B1 ANTITUMOR AGENT PHARMACIA & UPJOHN S.P.A. (IT) 2002-06-11 — — US disclosed
WO-2000066127-A1 NOVEL HIGHLY LIPOPHILIC CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2000-11-09 — — WO disclosed
CN-1048296-C Preparation method of 9-amino camptothecin PHARMACIA & UPJOHN SPA (IT) 2000-01-12 — — CN disclosed
CN-1222523-A Process for preparation of 9-amino camptothecin PHARMACIA & UPJOHN SPA (IT) 1999-07-14 — — CN disclosed
CN-1113384-A Preparation method of 9-amino camptothecin PHARMACIA SPA (IT) 1995-12-13 — — CN disclosed
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