SCHEMBL9755327

SCHEMBL9755327

COc1c(CO)cc2nc3ccccc3cc2c1Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 5/20 0.50
▸ RAD52 P43351 4/20 0.50
▸ TOP2A P11388 2/20 0.47
▸ TOP2B Q02880 2/20 0.47
▸ KDM1A O60341 11/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ GFER P55789 2/20 0.47
▸ HDAC3 O15379 1/20 0.42
▸ APP P05067 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 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
SCHEMBL9755355 0.89 KDM1A (0.50) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755338 0.89 KDM1A (0.53) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755414 0.89 KDM1A (0.45) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755350 0.89 KDM1A (0.45) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755411 0.85 POLB (0.47) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755413 0.84 TOP2A (0.50) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755380 0.81 POLB (0.47) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755390 0.81 TOP2A (0.55) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755438 0.77 KDM1A (0.53) POLBRAD52TOP2ATOP2BKDM1A
SCHEMBL9755333 0.77 KDM1A (0.51) POLBRAD52TOP2ATOP2BKDM1A

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 1 patent. 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 disclosed
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