SCHEMBL20070367

SCHEMBL20070367

COC1(C(=O)NC2(CN3CCOCC3)CCN(C)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.44
TDP1 Q9NUW8 2/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
HRH3 Q9Y5N1 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CTSS P25774 2/20 0.32
GLA P06280 1/20 0.32
CTSL P07711 1/20 0.32

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
SCHEMBL20147523 0.86 RET (0.42) RETKMT2AMEN1HRH3ALDH1A1
SCHEMBL20206053 0.84 RET (0.41) RETTDP1KMT2AMEN1HRH3
SCHEMBL20070364 0.79 RET (0.41) RETKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL20069516 0.78 RET (0.44) RETKMT2ALMNAALDH1A1
SCHEMBL20069523 0.77 RET (0.44) RETTDP1KMT2AMEN1SMN1; SMN2
SCHEMBL20070371 0.77 RET (0.46) RETTDP1KMT2AMEN1SMN1; SMN2
SCHEMBL20070365 0.76 RET (0.43) RETKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL20069520 0.75 RET (0.43) RETKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL20069721 0.75 RET (0.42) RETKMT2AMEN1HRH3SMN1; SMN2
SCHEMBL20069522 0.75 RET (0.43) RETKMT2AMEN1SMN1; SMN2ALDH1A1

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-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed