SCHEMBL16176142

SCHEMBL16176142

CCCOc1ccc(CN2CCC(N)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.66
ALDH1A1 P00352 2/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
CYP2D6 P10635 1/20 0.66
TSHR P16473 1/20 0.60
S1PR5 Q9H228 3/20 0.56
NPC1 O15118 3/20 0.56
HRH3 Q9Y5N1 6/20 0.56
TP53 P04637 2/20 0.55
HPGD P15428 1/20 0.55
LTA4H P09960 1/20 0.51
GAA P10253 1/20 0.51
HTR1A P08908 1/20 0.51
HTR2B P41595 1/20 0.51

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
SCHEMBL19189977 0.92 RAB9A (0.60) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL17967832 0.88 KDM4E (0.58) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL23775702 0.87 MEN1 (0.57) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL23775592 0.85 RAB9A (0.58) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL15033035 0.83 HRH3 (0.71) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL8791728 0.82 HRH3 (0.71) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL15071697 0.82 HRH3 (0.53) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL8791487 0.82 RAB9A (0.61) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL5175342 0.82 LTA4H (0.61) RAB9ANPC1HRH3LTA4H
SCHEMBL1586714 0.81 SIGMAR1 (0.63) MEN1KMT2A

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-2014167371-A1 ANALOGS OF THE ANTIBIOTIC AMINOTHIAZOLE GE2270 NAICONS S.C.A.R.L. (IT) 2014-10-16 WO disclosed