SCHEMBL16385954

SCHEMBL16385954

O=C(c1cccc(CCC2CCNCC2)c1)N1CCCCCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HPGD P15428 3/20 0.48
LMNA P02545 2/20 0.48
POLB P06746 1/20 0.48
PARP1 P09874 1/20 0.47
TP53 P04637 2/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
L3MBTL3 Q96JM7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL12736095 1.00 RAB9A (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12736091 0.99 PARP1 (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12736100 0.88 NPC1 (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL16385957 0.87 RAB9A (0.52) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL15310277 0.86 L3MBTL3 (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12736102 0.85 LMNA (0.58) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL16385959 0.85 RAB9A (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL15310435 0.84 L3MBTL3 (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12736127 0.84 L3MBTL3 (0.53) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12736106 0.81 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD

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-2607362-B1 Piperidine and piperazine carboxylates as FAAH inhibitors ASTELLAS PHARMA INC (JP) 2014-12-31 EP disclosed