SCHEMBL11037759

SCHEMBL11037759

C=C(C(=O)O)C(C)N1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAOB P27338 1/20 0.40
SLC6A2 P23975 6/20 0.39
CHRNB4 P30926 6/20 0.39
CHRNA3 P32297 6/20 0.39
SLC6A3 Q01959 6/20 0.39
CHRNB2 P17787 5/20 0.39
CHRNA4 P43681 5/20 0.39
CHRNA1 P02708 4/20 0.39
CHRNG P07510 4/20 0.39
CHRNB1 P11230 4/20 0.39
CHRND Q07001 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 3/20 0.38
GAA P10253 2/20 0.38
SLC6A4 P31645 1/20 0.38
ATM Q13315 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL5712749 0.98 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL6913113 0.82 MAOB (0.39) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL5799734 0.80 ALDH1A1 (0.41) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6454213 0.79 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL10939615 0.78 DPP7 (0.45) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL9583924 0.78 MAOB (0.44) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL14511335 0.78 DPP7 (0.45) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL2792423 0.78 DPP7 (0.45) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL4938808 0.78 DPP7 (0.45) ALDH1A1MEN1KMT2AMAOBSLC6A2
SCHEMBL94069 0.78 DPP7 (0.45) ALDH1A1MEN1KMT2AMAOBSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0164669-A2 Process for coating pharmaceutical forms RÖHM GMBH (DE) 1985-12-18 EP disclosed
US-4308120-A FREE-RADICAL POLYMERIZATION IN PRESENCE OF ULTRAVIOLET ABSORBER ROHM GMBH (DE) 1981-12-29 US disclosed
US-4105519-A POLYMERIZATION METHOD USING ULTRAVIOLET LIGHT ROHM GMBH (DE) 1978-08-08 US disclosed
US-4071653-A Powdery copolymer comprising methyl methacrylate and monomer having a basic nitrogen atom ROHM GMBH (DT) 1978-01-31 US disclosed