SCHEMBL16945812

SCHEMBL16945812

CCOC(=O)CNc1ccc2c(=O)n(CCN(C)C)nc3c2c1C(=O)c1ccccc1-3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ MITF O75030 1/20 0.46
▸ DNMT1 P26358 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ RAD52 P43351 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ UHRF1 Q96T88 1/20 0.46
▸ TDP1 Q9NUW8 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ TOP2A P11388 6/20 0.40
▸ GAA P10253 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.36
▸ RXRA P19793 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL15449640 0.85 POLB (0.49) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL15440469 0.83 SMN1; SMN2 (0.47) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL15440739 0.82 RAB9A (0.50) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL15440705 0.82 POLB (0.57) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL15440679 0.82 POLB (0.47) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL16945813 0.82 KMT2A (0.47) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL13468463 0.82 SMN1; SMN2 (0.46) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL15440706 0.82 KMT2A (0.46) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL13468116 0.82 SMN1; SMN2 (0.46) POLBL3MBTL1KMT2ANPC1MITF
SCHEMBL13281984 0.81 SMN1; SMN2 (0.42) POLBL3MBTL1KMT2ANPC1MITF

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
US-9096536-B2 Asymmetrically substituted anthrapyridazone derivatives as cytostatics BS-154 S.P. ZO.O. (PL) 2015-08-04 — — US disclosed
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