SCHEMBL9755399

SCHEMBL9755399

Cc1ccc2cc3c(Nc4ccccc4)c(C)c(CO)cc3nc2c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 4/20 0.48
▸ ACHE P22303 2/20 0.45
▸ TOP2A P11388 1/20 0.44
▸ TOP2B Q02880 1/20 0.44
▸ KMT2A Q03164 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ GAA P10253 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
SCHEMBL9755371 0.91 KDM1A (0.48) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755413 0.89 TOP2A (0.50) KDM1ATOP2ATOP2BKMT2AMEN1
SCHEMBL9755438 0.86 KDM1A (0.53) KDM1ATOP2ATOP2BKMT2ANPSR1
SCHEMBL9755414 0.86 KDM1A (0.45) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755321 0.83 ACHE (0.47) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755466 0.80 KDM1A (0.42) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755350 0.77 KDM1A (0.45) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755340 0.76 ACHE (0.38) KDM1AACHETOP2ATOP2BKMT2A
SCHEMBL9755338 0.75 KDM1A (0.53) KDM1ATOP2ATOP2BKMT2ANPSR1
SCHEMBL9594932 0.74 KDM1A (0.65) KDM1AACHETOP2ATOP2BKMT2A

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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