SCHEMBL28024936

SCHEMBL28024936

CC(C)(C)C(=O)ON1CCN(Cc2ccc(N)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
ALDH1A1 P00352 2/20 0.47
SIGMAR1 Q99720 1/20 0.42
HRH3 Q9Y5N1 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL27993844 0.87 POLB (0.50) ALDH1A1SIGMAR1HRH3KDM4EMEN1
SCHEMBL27981787 0.86 POLB (0.51) LMNAALDH1A1HRH3HTTKDM4E
SCHEMBL27524788 0.86 SIGMAR1 (0.53) LMNAALDH1A1SIGMAR1SMN1; SMN2KDM4E
SCHEMBL28055968 0.84 ALDH1A1 (0.41) ALDH1A1SIGMAR1HTTKDM4EMEN1
SCHEMBL28277616 0.84 ALDH1A1 (0.45) ALDH1A1HRH3SMN1; SMN2HTTL3MBTL1
SCHEMBL27844699 0.83 KDM4E (0.51) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL27844208 0.83 KMT2A (0.43) HRH3L3MBTL1MEN1KMT2AATM
SCHEMBL27659430 0.83 FAAH (0.40) LMNAALDH1A1HRH3SMN1; SMN2HTT
SCHEMBL28272975 0.83 CHKA (0.56) ALDH1A1SMN1; SMN2L3MBTL1HDAC6KDM4E
SCHEMBL28279084 0.82 ALDH1A1 (0.41) ALDH1A1HRH3SMN1; SMN2HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104837835-A VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LTD 2015-08-12 CN disclosed
CN-103626742-A Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN INC 2014-03-12 CN disclosed
CN-101981036-B Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2013-09-04 CN disclosed
CN-101370792-B Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN INC 2013-03-20 CN disclosed
CN-101506155-A Biphenyl derivatives and their use in the treatment of hepatitis C ARROW THERAPEUTICS LTD (GB) 2009-08-12 CN disclosed
CN-101370792-A Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN INC (US) 2009-02-18 CN disclosed