SCHEMBL9002877

SCHEMBL9002877

CCCCCCCCOC(=O)C(=O)CCCCCC

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.61
CES2 O00748 4/20 0.60
CES1 P23141 4/20 0.60
TSHR P16473 2/20 0.60
NAAA Q02083 1/20 0.55
DGKA P23743 1/20 0.55
EPHX1 P07099 1/20 0.52
RAD52 P43351 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HTR2C P28335 1/20 0.49
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47

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
SCHEMBL9002350 1.00 FAAH (0.61) FAAHCES2CES1TSHRNAAA
SCHEMBL10882394 1.00 FAAH (0.61) FAAHCES2CES1TSHRNAAA
SCHEMBL10878913 0.98 FAAH (0.59) FAAHCES2CES1TSHRNAAA
SCHEMBL10881373 0.98 FAAH (0.59) FAAHCES2CES1TSHRNAAA
SCHEMBL10879340 0.98 FAAH (0.59) FAAHCES2CES1TSHRNAAA
SCHEMBL10879023 0.98 FAAH (0.59) FAAHCES2CES1TSHRNAAA
SCHEMBL8639413 0.98 CES2 (0.58) FAAHCES2CES1TSHRNAAA
SCHEMBL8167954 0.96 FAAH (0.61) FAAHCES2CES1TSHRNAAA
SCHEMBL9340088 0.96 FAAH (0.61) FAAHCES2CES1TSHRNAAA
SCHEMBL3014435 0.94 CES2 (0.58) FAAHCES2CES1TSHRNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0731827-A1 DRILLING FLUID EXXON CHEMICAL PATENTS INC. (US) 1996-09-18 EP claimed
WO-1995015364-A1 DRILLING FLUID EXXON CHEMICAL PATENTS INC. (US) 1995-06-08 WO claimed