SCHEMBL9594830

SCHEMBL9594830

COc1cc2c(Nc3cccc(CO)c3)c3ccc(C)cc3nc2cc1C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 3/20 0.56
▸ TOP2B Q02880 3/20 0.56
▸ CSF1R P07333 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PDPK1 O15530 1/20 0.41
▸ KDM1A O60341 2/20 0.41
▸ ACHE P22303 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ EGFR P00533 2/20 0.39
▸ ERBB2 P04626 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ FBP1 P09467 1/20 0.38
▸ RAPGEF4 Q8WZA2 1/20 0.38

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
SCHEMBL9594388 0.96 TOP2A (0.56) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9594330 0.94 TOP2A (0.56) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9595752 0.94 TOP2A (0.58) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9593549 0.91 TOP2A (0.57) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9593668 0.91 TOP2A (0.57) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9594317 0.91 TOP2A (0.55) TOP2ATOP2BTP53MAPTPDPK1
SCHEMBL9594448 0.90 TOP2A (0.56) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9593497 0.89 TOP2A (0.57) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9594484 0.89 TOP2A (0.57) TOP2ATOP2BCSF1RTP53MAPT
SCHEMBL9592851 0.89 TOP2A (0.63) TOP2ATOP2BKDM1AACHEPOLB

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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