SCHEMBL20141948

SCHEMBL20141948

Cc1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1C(=O)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
TRPA1 O75762 1/20 0.49
LMNA P02545 5/20 0.49
ALDH1A1 P00352 2/20 0.49
HTT P42858 2/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 3/20 0.48
TSHR P16473 3/20 0.48
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HTR1A P08908 1/20 0.47
HTR7 P34969 1/20 0.47
RAB9A P51151 1/20 0.47
TP53 P04637 3/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL20141295 0.89 KDM4E (0.50) SMN1; SMN2LMNAALDH1A1HTTKDM4E
SCHEMBL20141688 0.89 MTOR (0.48) SMN1; SMN2LMNAHTTKDM4EKMT2A
SCHEMBL20140812 0.87 ALDH1A1 (0.56) SMN1; SMN2LMNAALDH1A1HTTKDM4E
SCHEMBL20140645 0.86 PPARG (0.49) TRPA1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL20141811 0.84 PPARG (0.46) SMN1; SMN2LMNAALDH1A1HTTKDM4E
SCHEMBL20140429 0.84 MTOR (0.48) SMN1; SMN2TRPA1ALDH1A1HTTKDM4E
SCHEMBL20141929 0.83 PPARG (0.47) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL20140664 0.83 MTOR (0.57) ALDH1A1HTTKDM4ENPSR1HTR1A
SCHEMBL20141357 0.83 MTOR (0.43) TRPA1MEN1KMT2AMAPT
SCHEMBL20157304 0.82 MTOR (0.47) SMN1; SMN2ALDH1A1HTTKDM4ETSHR

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-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed