SCHEMBL14979619

SCHEMBL14979619

Cc1ccc(OC(=O)N2CC(Oc3ccc(I)cn3)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.51
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ LIPE Q05469 9/20 0.43
▸ PIK3CD O00329 1/20 0.39
▸ GPR119 Q8TDV5 1/20 0.38
▸ CHRNA7 P36544 1/20 0.38
▸ MCHR1 Q99705 1/20 0.38
▸ BCHE P06276 1/20 0.37

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
SCHEMBL17082354 0.86 FAAH (0.49) FAAHLIPEGPR119MCHR1BCHE
SCHEMBL14979618 0.86 CYP1A2 (0.43) CYP1A2CYP2C9CYP2C19LIPEPIK3CD
SCHEMBL16866583 0.84 FAAH (0.48) FAAHLIPEGPR119MCHR1BCHE
SCHEMBL518160 0.84 FAAH (0.48) FAAHCYP1A2
SCHEMBL13692025 0.84 FAAH (0.47) FAAHCYP1A2LIPEGPR119MCHR1
SCHEMBL14979622 0.80 FAAH (0.59) FAAHGPR119MCHR1
SCHEMBL14979623 0.80 FAAH (0.57) FAAHCYP1A2CYP2C9CYP2C19LIPE
SCHEMBL28418487 0.80 FAAH (0.54) FAAHPIK3CDGPR119
SCHEMBL17074803 0.79 FAAH (0.60) FAAHMCHR1
SCHEMBL17082348 0.73 CHRNA7 (0.41) FAAHLIPEGPR119CHRNA7MCHR1

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-8450346-B2 Azetidine derivatives as FAAH inhibitors VERNALIS (R&D) LTD. (GB) 2013-05-28 — — US disclosed
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