SCHEMBL9502375

SCHEMBL9502375

CCOC(Nc1nc(N)nc(N)n1)OCC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 1/20 0.36
HTR7 P34969 7/20 0.32
ADRA1D P25100 3/20 0.32
ADRA1A P35348 3/20 0.32
ADRA1B P35368 3/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
JAK2 O60674 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HTR2C P28335 1/20 0.30
HTR6 P50406 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
SCHEMBL8130300 0.91 MEN1 (0.33) MEN1CYP1A2KMT2AHTR7ADRA1D
SCHEMBL5156866 0.82 CDK1 (0.35) HTR7ADRA1DADRA1AADRA1BMAPT
SCHEMBL9014254 0.81 MEN1 (0.34) MEN1CYP1A2KMT2AHTR7ADRA1D
SCHEMBL11425373 0.80 NPSR1 (0.54) NPC1RAB9A
SCHEMBL10581691 0.79
SCHEMBL15437996 0.78 MEN1 (0.33) MEN1CYP1A2KMT2AMAPTNPC1
SCHEMBL5162098 0.77 HTR7 (0.31) HTR7ADRA1DADRA1AADRA1BHTT
SCHEMBL8469216 0.77 CDK1 (0.34) MEN1CYP1A2KMT2AHTR7ADRA1D
SCHEMBL9613742 0.74 KCNH2 (0.34) HTR7ADRA1DADRA1AADRA1BMAPT
SCHEMBL10942115 0.73 HTR7 (0.32) HTR7ADRA1DADRA1AADRA1B

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-0301407-B1 WITH WOLLESTANT REINFORCED POLYOXYMETHYLENE MOLDING COMPOUNDS, PROCESS FOR THEIR FABRICATION, AND UTILISATION BASF Aktiengesellschaft (DE) 1993-05-12 EP disclosed
US-4987176-A MODULUS, TENSILE STRENGTH, IMPACT STRENGTH BASF AKTIENGESELLSCHAFT (DE) 1991-01-22 US disclosed
EP-0181542-B1 THERMOPLASTIC POLYOXYMETHYLENE MOULDING COMPOSITIONS HAVING A HIGHER ABRASION RESISTANCE BASF Aktiengesellschaft (DE) 1987-09-23 EP disclosed
US-4645785-A WOLLASTONITE, ETHERIFIED N-HYDROXYMETHYLMELAMINES, POLYSILOXANES, POLYETHYLENE BASF AKTIENGESELLSCHAFT (DE) 1987-02-24 US disclosed
EP-0181542-A1 Thermoplastic polyoxymethylene moulding compositions having a higher abrasion resistance BASF Aktiengesellschaft (DE) 1986-05-21 EP disclosed