SCHEMBL6725926

SCHEMBL6725926

C=C(C)C(=O)Nc1cc(N=Nc2ccccc2)c(NC(=O)C(=C)C)c(NC(=O)C(=C)C)c1NC(=O)C(=C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.47
▸ NPC1 O15118 4/20 0.47
▸ HTT P42858 4/20 0.47
▸ RAB9A P51151 5/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ TDP1 Q9NUW8 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ FTO Q9C0B1 1/20 0.35
▸ TRPA1 O75762 1/20 0.34
▸ LMNA P02545 2/20 0.34

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
SCHEMBL8578111 0.85 MAPT (0.45) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL4000024 0.82 CHRM1 (0.50) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL4293437 0.82 MAPT (0.52) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL13609827 0.77 MAPT (0.45) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL10491540 0.74 MAPT (0.70) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL4126180 0.74 MAPT (0.70) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL14690094 0.74 NPC1 (0.48) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL9450739 0.74 NPC1 (0.48) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL14690050 0.73 MAPT (0.51) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL4292105 0.72 THRB (0.43) MAPTNPC1HTTRAB9ATDP1

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-6677318-B1 Cross-linked agent for generation of a long-lasting satiety effect and method for the production of the said SCHUTTE/REICHEL GBR (DE) 2004-01-13 — — US disclosed
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