SCHEMBL19021784

SCHEMBL19021784

CCCC(=O)N(CC)C1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.62
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
GAA P10253 1/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 2/20 0.44
ATM Q13315 1/20 0.43
HSD11B1 P28845 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CASP6 P55212 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL19002588 0.98 L3MBTL1 (0.59) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL19049407 0.87 L3MBTL1 (0.56) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL30090134 0.86 L3MBTL1 (0.58) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL10677454 0.85 L3MBTL1 (0.59) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL25982230 0.85 L3MBTL1 (0.63) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL6607603 0.84 L3MBTL1 (0.57) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL4163355 0.84 L3MBTL1 (0.47) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL30251238 0.82 L3MBTL1 (0.55) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL664692 0.82 L3MBTL1 (0.55) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL22448021 0.82 L3MBTL1 (0.56) L3MBTL1MEN1KMT2AGAAALDH1A1

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-2017106134-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-06-22 WO disclosed