SCHEMBL4750495

SCHEMBL4750495

COCCOCOc1cccc(-c2noc(CCC3CCCC3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 4/20 0.50
TSHR P16473 2/20 0.50
RECQL P46063 1/20 0.50
MAPT P10636 5/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.42
FFAR1 O14842 1/20 0.42
THRB P10828 1/20 0.41
S1PR1 P21453 1/20 0.40
MAPK1 P28482 2/20 0.39
NPC1 O15118 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CPT2 P23786 1/20 0.39
CPT1A P50416 1/20 0.39
CPT1B Q92523 1/20 0.39

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
SCHEMBL4748124 0.78 L3MBTL1 (0.55) L3MBTL1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL4751183 0.77 MAPT (0.49) L3MBTL1RAB9ASMN1; SMN2TSHRMAPT
SCHEMBL4751171 0.71 HTT (0.55) L3MBTL1SMN1; SMN2MAPTFFAR1THRB
SCHEMBL1312376 0.68 RAB9A (0.71) L3MBTL1RAB9ASMN1; SMN2TSHRRECQL
SCHEMBL27457368 0.67 RAB9A (0.75) L3MBTL1RAB9ASMN1; SMN2TSHRRECQL
SCHEMBL1312733 0.67 RAB9A (0.70) L3MBTL1RAB9ASMN1; SMN2TSHRRECQL
SCHEMBL4222144 0.66 RAB9A (0.58) L3MBTL1RAB9ASMN1; SMN2TSHRRECQL
SCHEMBL30023217 0.66 RAB9A (0.58) L3MBTL1RAB9ASMN1; SMN2TSHRRECQL
SCHEMBL30639490 0.66 HTR6 (0.59) RAB9ASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL7295133 0.66 ACACB (0.69) L3MBTL1RAB9ASMN1; SMN2TSHRMAPT

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
WO-2008129129-A1 HETEROCYCLIC PHENYL CARBAMATES AS NOVEL FAAH-INHIBITORS KUOPION YLIOPISTO (FI) 2008-10-30 WO disclosed