SCHEMBL9592886

SCHEMBL9592886

COc1ccc2c(Nc3cccc(CO)c3)c3ccccc3nc2c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 4/20 0.75
▸ TOP2B Q02880 4/20 0.75
▸ KDM1A O60341 5/20 0.60
▸ KMT2A Q03164 5/20 0.57
▸ POLB P06746 5/20 0.57
▸ RAD52 P43351 4/20 0.57
▸ GFER P55789 2/20 0.57
▸ MEN1 O00255 3/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ OPRM1 P35372 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ ACP1 P24666 1/20 0.48
▸ HTT P42858 2/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ CYP19A1 P11511 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ TSHR P16473 1/20 0.47

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
SCHEMBL9594095 0.95 TOP2A (0.66) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9594311 0.93 TOP2A (0.64) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9595254 0.93 TOP2A (0.75) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9594844 0.91 TOP2A (0.61) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9595077 0.90 TOP2A (0.59) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9595112 0.89 TOP2A (0.59) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9595260 0.89 TOP2A (0.58) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9595379 0.89 TOP2A (0.58) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9594389 0.88 KDM1A (0.69) TOP2ATOP2BKDM1AKMT2APOLB
SCHEMBL9594471 0.88 TOP2A (0.66) TOP2ATOP2BKDM1AKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991005770-A1 POTENTIAL ANTICANCER AGENTS DERIVED FROM ACRIDINE SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1991-05-02 — — WO claimed
US-5229395-A Potential anticancer agents derived from acridine SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1993-07-20 — — US disclosed
WO-1991005770-A1 POTENTIAL ANTICANCER AGENTS DERIVED FROM ACRIDINE SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1991-05-02 — — WO disclosed
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