SCHEMBL11046478

SCHEMBL11046478

CCCC[C@H]1CCN[C@@H](C(N)=O)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.51
SLC6A3 Q01959 1/20 0.51
ARG1 P05089 1/20 0.45
PRCP P42785 2/20 0.43
CYP1A2 P05177 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
GRIA4 P48058 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40

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
SCHEMBL30938552 0.94 DRD3 (0.58) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL30887307 0.90 ARG1 (0.47) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL5515581 0.85 ARG1 (0.62) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL9811629 0.83 GRIN2D (0.44) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL1567292 0.81 ARG1 (0.60) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL3132033 0.80 ARG1 (0.47) DRD3SLC6A3ARG1CYP1A2MEN1
SCHEMBL28637907 0.79 DRD3 (0.60) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL27826683 0.79 DRD3 (0.60) DRD3SLC6A3ARG1PRCPCYP1A2
SCHEMBL18892593 0.79 ARG1 (0.44) DRD3SLC6A3ARG1CYP1A2MEN1
SCHEMBL18892648 0.79 ARG1 (0.46) ARG1CYP1A2MEN1ALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4464466-A CULTIVATING STREPTOMYCES THE UPJOHN COMPANY (US) 1984-08-07 US disclosed
US-4430495-A Process for preparing lincomycin and clindamycin ribonucleotides THE UPJOHN COMPANY (US) 1984-02-07 US disclosed
US-4383109-A ANTIBIOTICS, BACTERICIDES THE UPJOHN COMPANY (US) 1983-05-10 US disclosed
US-4368193-A NUCLEOTIDES THE UPJOHN COMPANY (US) 1983-01-11 US disclosed
US-4310660-A ANTIBIOTICS THE UPJOHN COMPANY (US) 1982-01-12 US disclosed
US-4309533-A BACTERICIDAL ANTIBIOTICS THE UPJOHN COMPANY (US) 1982-01-05 US disclosed