SCHEMBL7374207

SCHEMBL7374207

COc1ccc(CN)c(C(=O)OC(C)(C)C)c1OCC(=O)N1CCN(Cc2ccc3ccccc3n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.42
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
MCHR1 Q99705 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
CYP2C19 P33261 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
TP53 P04637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 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
SCHEMBL7373261 0.78 ALDH1A1 (0.49) FAAHALDH1A1SMN1; SMN2CYP3A4CYP2C9
SCHEMBL7374208 0.75 MEN1 (0.47) FAAHALDH1A1CYP3A4CYP2C9LMNA
SCHEMBL23775793 0.67 DRD2 (0.55) FAAHSMN1; SMN2MCHR1
SCHEMBL6586353 0.66 FAAH (0.66) FAAHALDH1A1SMN1; SMN2MCHR1MEN1
SCHEMBL15217937 0.66 FAAH (0.69) FAAHMCHR1
SCHEMBL27824207 0.66 FAAH (0.72) FAAHMCHR1MEN1KMT2A
SCHEMBL8489951 0.66 FAAH (0.52) FAAHALDH1A1SMN1; SMN2LMNAGAA
SCHEMBL3592480 0.65 FAAH (0.74) FAAHMCHR1MEN1KMT2A
SCHEMBL6192022 0.65 NPC1 (0.67) LMNAADRA1AADRA1BHTT
SCHEMBL11410763 0.65 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2CYP3A4CYP2C9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0706517-B1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL IND LTD (JP) 1998-10-21 EP disclosed
EP-0706517-A1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1996-04-17 EP disclosed
WO-1995001343-A1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1995-01-12 WO disclosed