SCHEMBL15519690

SCHEMBL15519690

CCn1cc(-c2nc(-c3cnc(C(=O)O)c(C)c3)c(Sc3ccc(Cl)cc3)o2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.43
KCNH2 Q12809 2/20 0.42
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.34
MEN1 O00255 1/20 0.33
CRHBP P24387 1/20 0.33
KMT2A Q03164 1/20 0.33
CRHR2 Q13324 1/20 0.33
ATR Q13535 1/20 0.33
PRKAB2 O43741 1/20 0.33
ABL1 P00519 1/20 0.33
CSF1R P07333 1/20 0.33
LYN P07948 1/20 0.33
TGFBR1 P36897 1/20 0.33
TGFBR2 P37173 1/20 0.33
PRKAG1 P54619 1/20 0.33

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
SCHEMBL15520521 0.87 FAAH (0.46) FAAHKCNH2KDM4EALDH1A1LMNA
SCHEMBL1001659 0.79 FAAH (0.48) FAAHKCNH2ALDH1A1LMNAABL1
SCHEMBL1001709 0.78 FAAH (0.56) FAAHKCNH2ATR
SCHEMBL15520830 0.73 FAAH (0.48) FAAHKCNH2
SCHEMBL1002457 0.69 FAAH (0.48) FAAHKCNH2
SCHEMBL1002383 0.69 FAAH (0.47) FAAHKCNH2KDM4EALDH1A1LMNA
SCHEMBL1004742 0.68 FAAH (0.71) FAAHKCNH2
SCHEMBL15520602 0.66 FAAH (0.56) FAAH
SCHEMBL15520083 0.65 FAAH (0.54) FAAH
SCHEMBL1004238 0.65 FAAH (0.69) FAAHKCNH2KDM4ELMNAMAPT

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
EP-2321288-B1 OXAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK SHARP & DOHME (US) 2014-03-19 EP claimed