SCHEMBL9592851

SCHEMBL9592851

Cc1ccc2c(Nc3cccc(CO)c3)c3cc(C)c(C)cc3nc2c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 4/20 0.63
▸ TOP2B Q02880 4/20 0.63
▸ KDM1A O60341 5/20 0.46
▸ ACHE P22303 2/20 0.45
▸ ABCG2 Q9UNQ0 2/20 0.42
▸ RAPGEF4 Q8WZA2 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ GAA P10253 1/20 0.39

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
SCHEMBL9595489 0.94 TOP2A (0.71) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9593811 0.93 TOP2A (0.63) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9593755 0.93 TOP2A (0.68) TOP2ATOP2BKDM1AABCG2RAPGEF4
SCHEMBL9593410 0.92 TOP2A (0.68) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9602386 0.89 TOP2A (0.81) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9594830 0.89 TOP2A (0.56) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9594388 0.89 TOP2A (0.56) TOP2ATOP2BKDM1AACHEABCG2
SCHEMBL9595398 0.86 KDM1A (0.51) TOP2ATOP2BKDM1AACHE
SCHEMBL9595752 0.86 TOP2A (0.58) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL9595379 0.86 TOP2A (0.58) TOP2ATOP2BKDM1ARAPGEF4MEN1

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
Send feedback