SCHEMBL2484178

SCHEMBL2484178

CC(C)(O)C(=O)N1CCN(C2=CC[CH]C=C2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.40
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RBP4 P02753 1/20 0.32
GPR183 P32249 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
HRH2 P25021 1/20 0.31
HRH1 P35367 1/20 0.31
MAPK1 P28482 1/20 0.31
NAMPT P43490 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL2480403 0.81 CASP6 (0.42) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL6639795 0.80 ALDH1A1 (0.46) MEN1KMT2AALDH1A1NAMPTMAPT
SCHEMBL2480266 0.76 AKR1C3 (0.42) MEN1KMT2AALDH1A1MAPK1MAPT
SCHEMBL2479566 0.74 SMO (0.37) MEN1KMT2AHTTMAPT
SCHEMBL2481886 0.72 NAMPT (0.42) NAMPTMAPT
SCHEMBL2481612 0.71 KDM4E (0.40) ALDH1A1MAPT
SCHEMBL2480196 0.70 FAAH (0.32) MEN1KMT2ANPC1
SCHEMBL2476107 0.68 CHRNA7 (0.42) KMT2AALDH1A1NPC1RAB9AMAPT
SCHEMBL695794 0.68 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1900342 0.68 ALDH1A1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376494-A1 DIHYDROPYRIMIDOPYRIMIDINE DERIVATIVES MSD K.K. (JP) 2011-10-19 EP disclosed
WO-2010067888-A1 DIHYDROPYRIMIDOPYRIMIDINE DERIVATIVES BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-06-17 WO disclosed