SCHEMBL27463599

SCHEMBL27463599

CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(CCC(N)=O)c4c(cc3nc2-1)OCO4

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 20/20 0.78
DDX5 P17844 1/20 0.69
RECQL P46063 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
KDM4E B2RXH2 1/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 1/20 0.61
RAB9A P51151 1/20 0.61
BLM P54132 1/20 0.61
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 1/20 0.60
GLA P06280 1/20 0.60
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60

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
SCHEMBL27477499 0.94 TOP1 (0.77) TOP1DDX5RECQLTDP1MEN1
SCHEMBL27461810 0.92 TOP1 (0.74) TOP1DDX5RECQLTDP1MEN1
SCHEMBL27477075 0.91 TOP1 (0.84) TOP1DDX5RECQLTDP1KDM4E
SCHEMBL27477911 0.90 TOP1 (0.71) TOP1DDX5RECQLTDP1MEN1
SCHEMBL27479909 0.90 TOP1 (0.79) TOP1DDX5RECQLTDP1MEN1
SCHEMBL24684716 0.88 TOP1 (1.00) TOP1DDX5RECQLTDP1KDM4E
SCHEMBL28177312 0.88 TOP1 (1.00) TOP1DDX5RECQLTDP1KDM4E
SCHEMBL31689186 0.88 TOP1 (1.00) TOP1DDX5RECQLTDP1KDM4E
SCHEMBL18296780 0.87 TOP1 (1.00) TOP1DDX5RECQLTDP1MEN1
SCHEMBL8487224 0.86 TOP1 (0.78) TOP1RECQLTDP1KDM4EPOLB

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
CN-1159192-A Substituted camptothecin derivatives and process for their preparation PHARMACIA & UPJOHN SPA (IT) 1997-09-10 CN claimed
CN-1159192-A Substituted camptothecin derivatives and process for their preparation PHARMACIA & UPJOHN SPA (IT) 1997-09-10 CN disclosed