SCHEMBL8882276

SCHEMBL8882276

O=C1CCCN1CCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
ADRA1B P35368 2/20 0.53
SIGMAR1 Q99720 1/20 0.53
GRIN2B Q13224 1/20 0.53
KMT2A Q03164 1/20 0.52
ACHE P22303 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TSHR P16473 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
ADRA1A P35348 1/20 0.50
KDM4E B2RXH2 1/20 0.49
PDK2 Q15119 1/20 0.49

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
SCHEMBL5872083 0.94 L3MBTL1 (0.67) L3MBTL1SIGMAR1KMT2AACHEGAA
SCHEMBL2132367 0.90 L3MBTL1 (0.60) L3MBTL1KMT2AACHEGAASMN1; SMN2
SCHEMBL18836848 0.85 SIGMAR1 (0.52) L3MBTL1SIGMAR1KMT2AGAASMN1; SMN2
SCHEMBL917005 0.85 L3MBTL1 (0.68) L3MBTL1SIGMAR1KMT2AACHEGAA
SCHEMBL13639218 0.84 RAB9A (0.49) KMT2ASMN1; SMN2TSHRRAB9AKDM4E
SCHEMBL10504904 0.84 KMT2A (0.48) L3MBTL1ADRA1BKMT2AGAATSHR
SCHEMBL13946711 0.84 RAB9A (0.55) L3MBTL1ADRA1BKMT2ANPC1RAB9A
SCHEMBL5872163 0.83 L3MBTL1 (0.71) L3MBTL1SIGMAR1ACHEGAASMN1; SMN2
SCHEMBL17117358 0.83 SIGMAR1 (0.56) SIGMAR1GRIN2BSLC6A3
SCHEMBL12518392 0.82 SIGMAR1 (0.53) L3MBTL1SIGMAR1KMT2ASMN1; SMN2NPC1

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-5591769-A PYRROLIDINE DERIVATIVES; ANTICOAGULANTS KARL THOMAE GMBH (DE) 1997-01-07 US disclosed