SCHEMBL9593647

SCHEMBL9593647

COc1cc2nc3cc(OC)c(OC)cc3c(Nc3ccc(CO)cc3)c2cc1OC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.50
▸ PDPK1 O15530 1/20 0.49
▸ MAP2K1 Q02750 4/20 0.48
▸ EGFR P00533 4/20 0.48
▸ KDR P35968 1/20 0.48
▸ CSF1R P07333 3/20 0.46
▸ TP53 P04637 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ SLC2A1 P11166 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ ERBB2 P04626 3/20 0.45
▸ ABCG2 Q9UNQ0 1/20 0.45
▸ PIK3CD O00329 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ PIK3CG P48736 1/20 0.44
▸ SRC P12931 1/20 0.44

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
SCHEMBL9593806 0.94 KDM1A (0.54) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9594966 0.94 KDM1A (0.54) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9594474 0.94 KDM1A (0.51) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9594446 0.92 HDAC1 (0.54) KDM1AMAP2K1EGFRCSF1RTP53
SCHEMBL9592698 0.92 KDM1A (0.53) KDM1APDPK1MAP2K1EGFRCSF1R
SCHEMBL9594824 0.92 SLC2A1 (0.48) KDM1APDPK1MAP2K1EGFRSLC2A1
SCHEMBL9594500 0.92 KDM1A (0.49) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9594205 0.89 KDM1A (0.48) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9595558 0.89 KDM1A (0.48) KDM1APDPK1MAP2K1EGFRKDR
SCHEMBL9595683 0.85 TOP2A (0.64) PDPK1EGFRKDRCSF1RTP53

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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