Sugi Predict

Sugi Predict / Compounds / Mazaticol

Mazaticol

Mazaticol

SCHEMBL13724754

CCN(CC)CCCOC(=O)C1(c2ccccc2)CC2CCC1C2.CN1[C@@H]2CCC(C)(C)[C@H]1C[C@H](OC(=O)C(O)(c1cccs1)c1cccs1)C2

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ CHRM2 P08172 12/20 0.35
▸ CHRM3 P20309 12/20 0.35
▸ CHRM1 P11229 10/20 0.35
▸ CHRM4 P08173 5/20 0.35
▸ CHRM5 P08912 3/20 0.32
▸ ADRA1A P35348 3/20 0.32
▸ HRH1 P35367 3/20 0.32
▸ OPRK1 P41145 3/20 0.32
▸ KCNH2 Q12809 3/20 0.32
▸ TSPO P30536 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.32
▸ ADRA2A P08913 2/20 0.31
▸ ADRA2C P18825 2/20 0.31
▸ TACR1 P25103 2/20 0.31
▸ PRCP P42785 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ POLB P06746 1/20 0.30

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
Mazaticol SCHEMBL34619 0.77 CHRM3 (0.51) CHRM2CHRM3CHRM1CHRM4CHRM5
Mazaticol SCHEMBL182361 0.77 CHRM3 (0.50) CHRM2CHRM3CHRM1CHRM4CHRM5
Mazaticol SCHEMBL28086106 0.76 CHRM3 (0.34) CHRM2CHRM3CHRM1CHRM4CHRM5
Mazaticol SCHEMBL17747972 0.76 CHRM3 (0.50) CHRM2CHRM3CHRM1CHRM4CHRM5
Bornaprine SCHEMBL924755 0.76 ALDH1A1 (0.56) ALDH1A1CHRM2CHRM3CHRM1CHRM4
Bornaprine SCHEMBL5705675 0.75 ALDH1A1 (0.55) ALDH1A1CHRM2CHRM3CHRM1CHRM4
Mazaticol SCHEMBL15229491 0.67 ADRA1A (0.39) CHRM2CHRM3CHRM1CHRM4CHRM5
SCHEMBL4886984 0.66 CHRM3 (0.60) CHRM2CHRM3CHRM1CHRM4CHRM5
SCHEMBL4886957 0.66 CHRM3 (0.60) CHRM2CHRM3CHRM1CHRM4CHRM5
SCHEMBL4886970 0.66 CHRM3 (0.60) CHRM2CHRM3CHRM1CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 — — EP disclosed
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 — — EP disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 — — WO disclosed
WO-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 — — WO disclosed