SCHEMBL16401700

SCHEMBL16401700

O=C(NC1CCCCC1)OCc1nn[nH]c1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.55
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.46
EPHX2 P34913 1/20 0.45
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
SGMS2 Q8NHU3 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42

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
SCHEMBL16401779 0.90 EPHX1 (0.54) EPHX1ALDH1A1MEN1KMT2AGAA
SCHEMBL16401739 0.90 EPHX1 (0.48) EPHX1ALDH1A1MEN1KMT2AGAA
SCHEMBL16401896 0.89 EPHX1 (0.47) EPHX1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL16401566 0.88 EPHX1 (0.44) EPHX1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL16401828 0.88 EPHX1 (0.50) EPHX1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL16401635 0.85 EPHX1 (0.49) EPHX1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL16401693 0.82 EPHX1 (0.60) EPHX1ALDH1A1MEN1KMT2AGAA
SCHEMBL16401900 0.80 EPHX1 (0.51) EPHX1ALDH1A1MEN1KMT2AGAA
SCHEMBL16401879 0.79 KMT2A (0.45) EPHX1ALDH1A1MEN1KMT2AEPHX2
SCHEMBL8393719 0.78 EPHX1 (0.84) EPHX1ALDH1A1MEN1KMT2AGAA

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
WO-2015007613-A1 O-ALKYL TRIAZOLYL CARBAMATES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-01-22 WO disclosed