SCHEMBL3274902

SCHEMBL3274902

Fc1ccc(-c2cc(N3CCNCC3)ccn2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.53
HRH4 Q9H3N8 3/20 0.45
HTR1A P08908 2/20 0.45
HTR7 P34969 2/20 0.45
ADRB2 P07550 1/20 0.44
NCF1 P14598 1/20 0.44
PLD1 Q13393 1/20 0.44
KCNH2 Q12809 1/20 0.43
MAPK14 Q16539 1/20 0.43
FEN1 P39748 1/20 0.42
ACVR1 Q04771 1/20 0.41
CHEK1 O14757 3/20 0.40
KMO O15229 1/20 0.40
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
IDO2 Q6ZQW0 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
ELOVL1 Q9BW60 1/20 0.39
ALK Q9UM73 1/20 0.39

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
SCHEMBL15445062 0.82 ADRB2 (0.62) HRH4HTR1AHTR7ADRB2NCF1
SCHEMBL3267544 0.80 FAAH (0.53) FAAHFEN1KMO
SCHEMBL3275107 0.78 CYP1A2 (0.59) FAAHHRH4FEN1KMOELOVL1
SCHEMBL3270026 0.76 NMT1 (0.58) FAAHPLD1
SCHEMBL3267995 0.75 HTR7 (0.69) HTR1AHTR7KCNH2MAPK14
SCHEMBL3269261 0.75 CYP1A2 (0.57) FAAHHRH4PLD1
Hydrochloric Acid SCHEMBL3269946 0.75 NMT1 (0.57) FAAHPLD1
SCHEMBL27102997 0.75 ADRB2 (0.56) HRH4HTR1AHTR7ADRB2NCF1
SCHEMBL4864316 0.74 FAAH (0.46) FAAHMAPK14KMO
SCHEMBL19072696 0.74 KMO (0.54) FAAHMAPK14KMO

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
US-20100234389-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-16 US disclosed
EP-2199282-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-06-23 EP disclosed
US-20090163508-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100234389-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA FAAH 1/4885HRH4 24/4885HTR1A 1025/4885
US-20090163508-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA FAAH 1/4885HRH4 24/4885HTR1A 1025/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.