SCHEMBL11501640

SCHEMBL11501640

N=C(NC(N)=O)NC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.47
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.41
NFKB1 P19838 2/20 0.41
CYP1A2 P05177 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
THPO P40225 1/20 0.41
CA2 P00918 1/20 0.41
CYP3A4 P08684 1/20 0.41
CA5A P35218 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 1/20 0.33
OR51E2 Q9H255 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ACHE P22303 1/20 0.31
TAS2R38 P59533 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
SCHEMBL23454433 0.91 CRBN (0.41) CRBNLMNATSHRNFKB1CYP1A2
SCHEMBL17198966 0.82
SCHEMBL11922967 0.80 CRBN (0.39) CRBNLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL11151241 0.80 CRBN (0.43) CRBNLMNATSHRNFKB1CYP1A2
Hydrochloric Acid SCHEMBL11303450 0.80
SCHEMBL146394 0.79
SCHEMBL2746380 0.78 CRBN (0.42) CRBNTAS2R38
SCHEMBL27939070 0.76 CRBN (0.60) CRBNLMNATSHRNFKB1CYP1A2
SCHEMBL15045 0.76
SCHEMBL27524722 0.76 CRBN (0.60) CRBNLMNATSHRNFKB1CYP1A2

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-4166827-A DENTAL PLAQUE COOPER LABORATORIES, INC. (US) 1979-09-04 US disclosed
US-4163022-A ANTIPLAQUE AGENTS COOPER LABORATORIES, INC. (US) 1979-07-31 US disclosed
US-4115448-A Carbamylguanidine antimicrobial compounds COOPER LABORATORIES, INC. (US) 1978-09-19 US disclosed
US-4115447-A Carbamylguanidine antimicrobial compounds COOPER LABORATORIES, INC. (US) 1978-09-19 US disclosed
US-4110328-A Bis-carbamylguanidinoazaalkane antimicrobial compounds COOPER LABORATORIES, INC. (US) 1978-08-29 US disclosed
US-4022962-A DENTAL PLAQUE INHIBITORS COOPER LABORATORIES, INC. (US) 1977-05-10 US disclosed