SCHEMBL7735189

SCHEMBL7735189

OCCCc1cc(Cl)cc2nc(Cc3c(F)cccc3Cl)oc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GLA P06280 1/20 0.33
RAB9A P51151 1/20 0.33
DAO P14920 1/20 0.33
HTT P42858 1/20 0.32
PPP1CA P62136 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
ERAP1 Q9NZ08 1/20 0.32

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
SCHEMBL7734855 0.92 SIRT2 (0.34) MEN1KMT2ASIRT2
SCHEMBL7734231 0.86 RAB9A (0.40) ALDH1A1KMT2APOLBNPC1L3MBTL1
SCHEMBL7734862 0.85 SLC22A12 (0.41) ALDH1A1KDM4E
SCHEMBL7734337 0.83 NLRP3 (0.36) MAPTL3MBTL1SIRT2
SCHEMBL7735662 0.80 NPC1 (0.42) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7733875 0.80 LMNA (0.41) MEN1KMT2APOLBMAPTSMN1; SMN2
SCHEMBL7734700 0.79 NLRP3 (0.35) MAPTL3MBTL1
SCHEMBL7734093 0.79 SIRT2 (0.37) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7734848 0.79 MAPT (0.38) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7724872 0.79 GAA (0.36) GAAALDH1A1MEN1KMT2ANPSR1

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-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US claimed