SCHEMBL5804341

SCHEMBL5804341

CC(C)(C)OC(=O)N1CCC(N2CCC(n3ccc(-c4ccc(Oc5ccccc5)cc4)n3)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.51
BTK Q06187 6/20 0.47
HTT P42858 2/20 0.44
USP30 Q70CQ3 2/20 0.44
GPR119 Q8TDV5 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
SCN4A P35499 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OGFRL1 Q5TC84 1/20 0.42
USP2 O75604 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL1781995 0.88 USP30 (0.53) USP30GPR119KDM4EMEN1KMT2A
SCHEMBL6640044 0.82 BTK (0.46) TNK2BTKALDH1A1SCN4ANPC1
SCHEMBL5805292 0.81 PLAUR (0.42) TNK2BTKSCN4A
SCHEMBL31466305 0.79 HTT (0.44) HTTUSP30GPR119KDM4EMEN1
SCHEMBL5803839 0.79 HCK (0.46) BTKSCN4A
SCHEMBL22720878 0.79 SCN4A (0.42) TNK2BTKSCN4ANPC1RAB9A
SCHEMBL16597957 0.78 BTK (0.61) TNK2BTKHTTGPR119KDM4E
SCHEMBL23217070 0.78 BTK (0.52) TNK2BTKSCN4A
SCHEMBL22721138 0.77 PLAUR (0.40) TNK2BTKSCN4A
SCHEMBL16597626 0.77 BTK (0.71) TNK2BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385524-A4 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO KG (DE) 2006-02-01 EP disclosed
CN-1520298-A Pyrazolopyrimidines as therapeutic agents �����ʩ���عɷݹ�˾ 2004-08-11 CN disclosed
EP-1385524-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS Abbott GmbH & Co. KG (DE) 2004-02-04 EP disclosed
CN-1390219-A Pyrazolopyrimidines as therapeutic agents ABBOTT AG (DE) 2003-01-08 CN disclosed
WO-2002080926-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO. KG (DE) 2002-10-17 WO disclosed