SCHEMBL18595264

SCHEMBL18595264

CCCCCCC(CCCCC)C(C)OC(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.44
ZDHHC7 Q9NXF8 1/20 0.42
LMNA P02545 2/20 0.41
ABCB1 P08183 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
CA1 P00915 1/20 0.39
MAPT P10636 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL26478576 0.98 FAAH (0.43) FAAHZDHHC7LMNAABCB1ALDH1A1
SCHEMBL19441279 0.93 FAAH (0.42) FAAHZDHHC7LMNAABCB1ALDH1A1
SCHEMBL18595316 0.84 LMNA (0.50) FAAHZDHHC7LMNACNR1CNR2
SCHEMBL18558918 0.84 ZDHHC7 (0.47) FAAHZDHHC7LMNAABCB1CNR1
SCHEMBL19333632 0.84 LMNA (0.50) FAAHZDHHC7LMNACNR1CNR2
SCHEMBL22267806 0.83 ZDHHC7 (0.40) FAAHZDHHC7LMNAABCB1CNR1
SCHEMBL5608104 0.82 FAAH (0.58) FAAHZDHHC7LMNAABCB1ALDH1A1
SCHEMBL28850975 0.82 FAAH (0.58) FAAHZDHHC7LMNAABCB1ALDH1A1
SCHEMBL18595203 0.82 FAAH (0.46) FAAHZDHHC7LMNAABCB1CNR1
SCHEMBL18856343 0.81 FAAH (0.47) FAAHFFAR1

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-9586931-B2 Triazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2017-03-07 US disclosed