SCHEMBL20159302

SCHEMBL20159302

CCc1cc(C(=O)N2CCN(c3ccccc3)CC2)n(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.53
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 5/20 0.51
TSHR P16473 4/20 0.51
MEN1 O00255 4/20 0.51
USP2 O75604 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
ALOX15 P16050 1/20 0.49
APOBEC3A P31941 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL20140559 0.80 MTOR (0.52) DRD2HTR2AKMT2ATSHRMEN1
SCHEMBL20159024 0.80 MTOR (0.64) DRD2HTR2AKMT2AMEN1POLB
SCHEMBL20139683 0.80 KMT2A (0.51) TP53DRD2HTR2AMAPTKMT2A
SCHEMBL20159166 0.79 POLB (0.55) DRD2HTR2AKMT2ATSHRMEN1
SCHEMBL20159007 0.79 POLB (0.55) DRD2HTR2AKMT2ATSHRMEN1
SCHEMBL20159123 0.78 MTOR (0.69) TP53DRD2HTR2A
SCHEMBL20158948 0.77 MTOR (0.49) TP53DRD2HTR2AKMT2AMEN1
SCHEMBL27629593 0.77 KMT2A (0.71) DRD2HTR2AMAPTKMT2ATSHR
SCHEMBL20139225 0.76 MTOR (0.50) DRD2HTR2AKMT2A
SCHEMBL5658689 0.75 USP2 (0.78) TP53MAPTKMT2ATSHRMEN1

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-2018089493-A1 PYRROLE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed