SCHEMBL9594966

SCHEMBL9594966

COc1cc2c(Nc3ccc(CO)cc3)c3cc(OC)c(OC)cc3nc2cc1C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.54
▸ PDPK1 O15530 1/20 0.46
▸ SLC2A1 P11166 1/20 0.44
▸ MAP2K1 Q02750 4/20 0.44
▸ EGFR P00533 3/20 0.44
▸ ERBB2 P04626 2/20 0.44
▸ KDR P35968 1/20 0.44
▸ TP53 P04637 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ POLB P06746 2/20 0.43
▸ RAD52 P43351 1/20 0.43
▸ CSF1R P07333 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.41

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 0.98 KDM1A (0.54) KDM1APDPK1SLC2A1MAP2K1EGFR
SCHEMBL9594474 0.95 KDM1A (0.51) KDM1APDPK1SLC2A1MAP2K1EGFR
SCHEMBL9595558 0.95 KDM1A (0.48) KDM1APDPK1SLC2A1MAP2K1EGFR
SCHEMBL9594205 0.95 KDM1A (0.48) KDM1APDPK1SLC2A1MAP2K1EGFR
SCHEMBL9593647 0.94 KDM1A (0.50) KDM1APDPK1SLC2A1MAP2K1EGFR
SCHEMBL9594919 0.91 MEN1 (0.46) KDM1ASLC2A1EGFRERBB2POLB
SCHEMBL9592981 0.91 KDM1A (0.47) KDM1ASLC2A1EGFRERBB2POLB
SCHEMBL9594286 0.90 HDAC1 (0.52) KDM1AMAPTPOLBRAD52MEN1
SCHEMBL9592115 0.90 KDM1A (0.50) KDM1AMAP2K1TP53MAPTPOLB
SCHEMBL9594855 0.89 KDM1A (0.47) KDM1ASLC2A1EGFRERBB2POLB

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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