SCHEMBL9755371

SCHEMBL9755371

Cc1ccc2nc3cc(CO)c(C)c(Nc4ccccc4)c3cc2c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.48
▸ ACHE P22303 1/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TOP2A P11388 1/20 0.44
▸ TOP2B Q02880 1/20 0.44
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL9755399 0.91 KDM1A (0.48) KDM1AACHEKMT2ANPSR1TOP2A
SCHEMBL9755413 0.89 TOP2A (0.50) KDM1AKMT2ATOP2ATOP2BMEN1
SCHEMBL9755350 0.86 KDM1A (0.45) KDM1AACHEKMT2ANPSR1TOP2A
SCHEMBL9755337 0.80 KMT2A (0.42) KDM1AACHEKMT2ANPSR1TOP2A
SCHEMBL9755438 0.80 KDM1A (0.53) KDM1AKMT2ANPSR1TOP2ATOP2B
SCHEMBL9755414 0.77 KDM1A (0.45) KDM1AACHEKMT2ANPSR1TOP2A
SCHEMBL9755373 0.76 ACHE (0.39) KDM1AACHEKMT2ANPSR1MEN1
SCHEMBL9755390 0.76 TOP2A (0.55) KDM1AKMT2ATOP2ATOP2BMEN1
SCHEMBL9755355 0.75 KDM1A (0.50) KDM1AKMT2ANPSR1TOP2ATOP2B
SCHEMBL9594083 0.74 KDM1A (0.67) KDM1ATOP2ATOP2B

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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