SCHEMBL20070541

SCHEMBL20070541

Cc1cc(CN2C3CC2CN(C)C3)no1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
RECQL P46063 1/20 0.42
RET P07949 1/20 0.38
EPHX2 P34913 1/20 0.35
GABRA5 P31644 2/20 0.34
GABRA1 P14867 1/20 0.34
GRM2 Q14416 1/20 0.34
GRIN2B Q13224 6/20 0.33
GRIN1 Q05586 4/20 0.33
NMT1 P30419 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYBB P04839 1/20 0.33
NOX5 Q96PH1 1/20 0.33
CHRNA4 P43681 1/20 0.33
AURKA O14965 2/20 0.33
KCNH2 Q12809 2/20 0.33
AURKB Q96GD4 1/20 0.33
AURKC Q9UQB9 1/20 0.33

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
SCHEMBL21158902 0.86 MAPT (0.41) MAPTRECQLRETEPHX2GABRA5
SCHEMBL20149614 0.84 MAPT (0.40) MAPTRECQLRETEPHX2GABRA5
SCHEMBL20148638 0.84 RET (0.40) MAPTRECQLRETEPHX2GABRA5
SCHEMBL21158717 0.82 RET (0.40) RETEPHX2
SCHEMBL20070423 0.74 RET (0.38) RETGRIN2BGRIN1
SCHEMBL22031280 0.73 RET (0.37) RETCHRNA4
SCHEMBL22031271 0.72 RET (0.37) RETGRIN2BGRIN1
SCHEMBL22811895 0.72 RET (0.37) RETGRIN2BGRIN1
SCHEMBL22030584 0.72 TAS2R8 (0.38) RETALDH1A1
SCHEMBL20071341 0.72 RET (0.39) RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3753939-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma Inc. (US) 2020-12-23 EP disclosed
EP-3523301-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-05-27 EP disclosed
WO-2018071447-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed