SCHEMBL9752272

SCHEMBL9752272

N#CNC(=O)C1C2C=CC(CC2)C1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK10 P53779 1/20 0.32

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
SCHEMBL9633467 0.79 USP2 (0.32)
SCHEMBL2546254 0.79 POLB (0.59) POLBAPEX1TDP1
SCHEMBL9550446 0.77
SCHEMBL15938804 0.72 ALDH1A1 (0.40) POLBTDP1
SCHEMBL15938802 0.72 ALDH1A1 (0.40) POLBTDP1
SCHEMBL9550312 0.69
SCHEMBL251917 0.67 KDM4E (0.44) POLBTDP1
SCHEMBL9073184 0.66 ALDH1A1 (0.41) POLBAPEX1TDP1
SCHEMBL2549326 0.66 ALDH1A1 (0.41) POLBAPEX1TDP1
SCHEMBL9013068 0.66 ALDH1A1 (0.42) POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991001307-A2 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1991-02-07 WO disclosed