SCHEMBL27446239

SCHEMBL27446239

COc1ccc(CCCNC(C)=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.81
MTNR1A P48039 6/20 0.68
MTNR1B P49286 6/20 0.68
POLB P06746 1/20 0.65

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
SCHEMBL659053 0.90 SMN1; SMN2 (1.00) SMN1; SMN2MTNR1AMTNR1B
SCHEMBL8577834 0.85 POLB (0.63) SMN1; SMN2POLB
SCHEMBL15929126 0.84 MTNR1A (0.69) SMN1; SMN2MTNR1AMTNR1B
SCHEMBL11435187 0.84 SMN1; SMN2 (0.62) SMN1; SMN2MTNR1AMTNR1BPOLB
SCHEMBL12405428 0.83 ACACB (0.71) SMN1; SMN2MTNR1AMTNR1B
SCHEMBL25335984 0.83 CYP2D6 (0.68) SMN1; SMN2POLB
SCHEMBL16562076 0.81 FPR2 (0.73) SMN1; SMN2
SCHEMBL8928104 0.81 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL5072982 0.81 POLB (0.58) SMN1; SMN2MTNR1AMTNR1BPOLB
SCHEMBL29699652 0.81 POLB (0.58) SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1118464-C Noval pyrimidine derivatives and process and preparing thereof YUHAN CORP (KR) 2003-08-20 CN disclosed
CN-1251586-A Noval pyrimidine derivatives and process and preparing thereof YUHAN CORP (KR) 2000-04-26 CN disclosed