SCHEMBL7368700

SCHEMBL7368700

CCOC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TMEM97 Q5BJF2 4/20 0.48
SIGMAR1 Q99720 4/20 0.48
SLC6A2 P23975 2/20 0.48
HRH2 P25021 2/20 0.48
HRH1 P35367 2/20 0.48
HTR1A P08908 1/20 0.48
CHRM5 P08912 1/20 0.48
ADRA1D P25100 1/20 0.48
HTR1B P28222 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR1E P28566 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
CHRM1 P11229 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48

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
SCHEMBL28426480 0.89 HTT (0.52) RAB9ASMN1; SMN2NPC1TMEM97SIGMAR1
SCHEMBL7007408 0.89 TMEM97 (0.56) RAB9ASMN1; SMN2NPC1L3MBTL1TMEM97
SCHEMBL8386105 0.87 KMT2A (0.52) RAB9ASMN1; SMN2NPC1TMEM97SIGMAR1
SCHEMBL4388657 0.86 MEN1 (0.45) RAB9ASMN1; SMN2NPC1TMEM97SIGMAR1
SCHEMBL28432287 0.86 MEN1 (0.47) RAB9ASMN1; SMN2NPC1L3MBTL1TMEM97
SCHEMBL16475199 0.84 TMEM97 (0.52) RAB9ASMN1; SMN2NPC1TMEM97SIGMAR1
SCHEMBL3902852 0.83 SMN1; SMN2 (0.56) RAB9ASMN1; SMN2NPC1L3MBTL1TMEM97
SCHEMBL28429226 0.82 MEN1 (0.48) RAB9ASMN1; SMN2NPC1TMEM97SIGMAR1
SCHEMBL28439343 0.82 MEN1 (0.50) RAB9ASMN1; SMN2NPC1L3MBTL1TMEM97
SCHEMBL5551353 0.82 KDM4E (0.62) RAB9ASMN1; SMN2NPC1L3MBTL1TMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211183-B1 PIPERAZINE DERIVATIVE ANTICOAGULANTS; ANTIISCHEMIC AGENTS; CARDIOVASCULAR DISORDERS COR THERAPEUTICS, INC. 2001-04-03 US disclosed
EP-0975625-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 2000-02-02 EP disclosed
WO-1998046591-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 1998-10-22 WO disclosed