SCHEMBL13589447

SCHEMBL13589447

CCCCNC(=O)c1ccc(CCN)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ PLK1 P53350 1/20 0.55
▸ TMEM97 Q5BJF2 2/20 0.54
▸ SIGMAR1 Q99720 2/20 0.54
▸ NAAA Q02083 2/20 0.54
▸ ESRRG P62508 2/20 0.54
▸ CA2 P00918 2/20 0.54
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ HDAC3 O15379 1/20 0.53
▸ MLYCD O95822 1/20 0.51
▸ TSHR P16473 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ HTR2A P28223 1/20 0.50
▸ CA12 O43570 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA9 Q16790 1/20 0.50

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
Hydrochloric Acid SCHEMBL4389040 0.98 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2PLK1TMEM97SIGMAR1
SCHEMBL10949132 0.89 PLK1 (0.70) L3MBTL1SMN1; SMN2PLK1TMEM97SIGMAR1
SCHEMBL10950073 0.89 PLK1 (0.64) L3MBTL1SMN1; SMN2PLK1TMEM97SIGMAR1
SCHEMBL8122188 0.87 SMN1; SMN2 (0.63) L3MBTL1SMN1; SMN2TMEM97SIGMAR1NAAA
SCHEMBL26553937 0.87 L3MBTL1 (0.60) L3MBTL1PLK1TMEM97SIGMAR1NAAA
Hydrochloric Acid SCHEMBL25401659 0.85 L3MBTL1 (0.58) L3MBTL1PLK1TMEM97SIGMAR1NAAA
SCHEMBL26553938 0.85 THRA (0.57) L3MBTL1PLK1NAAACA2MEN1
SCHEMBL28326194 0.85 L3MBTL1 (0.73) L3MBTL1SMN1; SMN2NAAACA2NPC1
SCHEMBL13375744 0.84 L3MBTL1 (0.69) L3MBTL1SMN1; SMN2PLK1TMEM97SIGMAR1
SCHEMBL23840600 0.84 HPGD (0.62) L3MBTL1SMN1; SMN2TMEM97SIGMAR1ESRRG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629358-B2 Compounds useful for the treatment of diseases PFIZER INC (US) 2009-12-08 — — US disclosed
US-7629358-B2 Compounds useful for the treatment of diseases PFIZER INC (US) 2009-12-08 — — US disclosed
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