SCHEMBL16555271

SCHEMBL16555271

CCCCCCCC([C]=O)C(C)[C]=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
OPRM1 P35372 1/20 0.39
FFAR1 O14842 2/20 0.38
FFAR4 Q5NUL3 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
SPHK1 Q9NYA1 1/20 0.38
CA1 P00915 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.36
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 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
SCHEMBL214294 0.84 MAPT (0.42) MAPTADH1BADH1CADH1AADH4
SCHEMBL10436066 0.83 MAPT (0.41) MAPTADH1BADH1CADH1AADH4
SCHEMBL7198180 0.81 MAPT (0.39) MAPTADH1BADH1CADH1AADH4
SCHEMBL18115130 0.81 MAPT (0.39) MAPTADH1BADH1CADH1AADH4
SCHEMBL8411270 0.80 MAPT (0.42) MAPTADH1BADH1CADH1AADH4
SCHEMBL10424212 0.78 MAPT (0.41) MAPTADH1BADH1CADH1AADH4
SCHEMBL1409547 0.77 OPRM1 (0.42) MAPTADH1BADH1CADH1AADH4
SCHEMBL10380231 0.77 SPHK1 (0.50) MAPTFFAR1FFAR4GPR84SPHK1
SCHEMBL10380788 0.77 SPHK1 (0.50) MAPTFFAR1FFAR4GPR84SPHK1
SCHEMBL7180270 0.75 GPR84 (0.44) MAPTFFAR1FFAR4GPR84FDPS

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
CN-105764902-B Spiro-compound as tryptophan hydroxylase inhibitor 卡罗斯制药公司 2019-02-15 CN disclosed
EP-3041842-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS Karos Pharmaceuticals, Inc. (US) 2016-07-13 EP disclosed
WO-2015035113-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS KAROS PHARMACEUTICALS, INC. (US) 2015-03-12 WO disclosed