SCHEMBL9755338

SCHEMBL9755338

COc1ccc2cc3c(Nc4ccccc4)c(OC)c(CO)cc3nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 5/20 0.53
▸ POLB P06746 3/20 0.49
▸ RAD52 P43351 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ GFER P55789 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ PDGFRB P09619 2/20 0.45
▸ PDGFRA P16234 2/20 0.45
▸ EGFR P00533 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ PHLPP2 Q6ZVD8 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ TOP2A P11388 1/20 0.41
▸ TOP2B Q02880 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ L3MBTL1 Q9Y468 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 0.91 KDM1A (0.50) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755438 0.89 KDM1A (0.53) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755414 0.89 KDM1A (0.45) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755327 0.89 POLB (0.50) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755411 0.83 POLB (0.47) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755351 0.83 KDM1A (0.50) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755350 0.83 KDM1A (0.45) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755378 0.75 KDM1A (0.44) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9594389 0.75 KDM1A (0.69) KDM1APOLBRAD52KMT2AGFER
SCHEMBL9755399 0.75 KDM1A (0.48) KDM1AKMT2AMEN1TOP2ATOP2B

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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