SCHEMBL23374166

SCHEMBL23374166

C=C(CCCCCC)C(C)N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.43
SPHK2 Q9NRA0 1/20 0.43
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
OPRM1 P35372 1/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
FAAH O00519 1/20 0.41
MAPK1 P28482 1/20 0.41
PPARG P37231 6/20 0.39
PPARD Q03181 6/20 0.39
PPARA Q07869 6/20 0.39
GPR84 Q9NQS5 5/20 0.39
HDAC11 Q96DB2 5/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 2/20 0.39
TLR2 O60603 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FABP4 P15090 2/20 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
SCHEMBL18660169 0.81 CES2 (0.44) CES2CES1LMNAMEN1KMT2A
SCHEMBL18819438 0.81 CES2 (0.44) CES2CES1LMNAMEN1KMT2A
SCHEMBL23844952 0.81 CES2 (0.44) CES2CES1LMNAMEN1KMT2A
SCHEMBL25110725 0.81 CES2 (0.44) CES2CES1LMNAMEN1KMT2A
SCHEMBL22986927 0.80 SPHK2 (0.41) SPHK1SPHK2CES2CES1MEN1
SCHEMBL19057211 0.78 CES2 (0.42) CES2CES1LMNAMEN1KMT2A
SCHEMBL28110472 0.76 CES2 (0.44) CES2CES1MEN1KMT2APPARG
SCHEMBL23926079 0.76 CES2 (0.40) CES2CES1LMNAMEN1KMT2A
SCHEMBL9856778 0.76 FFAR4 (0.47) SPHK1LMNAMEN1KMT2AFAAH
SCHEMBL7743756 0.76 FFAR4 (0.47) SPHK1LMNAMEN1KMT2AFAAH

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-20210146047-A1 COMBINED ANALYTE SENSOR AND INFUSION SET CITIBANK, N.A. 2021-05-20 US disclosed