SCHEMBL27312705

SCHEMBL27312705

CSN(C=O)Nn1nc(N)nc1N1CCOCC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
NUDT1 P36639 1/20 0.30
HSD17B10 Q99714 1/20 0.30
POLB P06746 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
SCHEMBL27309894 0.81 HSD17B10 (0.35) HSD17B10POLB
SCHEMBL27518968 0.77 ALDH1A1 (0.30)
SCHEMBL27337796 0.67 HTT (0.49) CRHBPCRHR2
SCHEMBL27330065 0.66 CYP11B2 (0.46)
SCHEMBL27315747 0.64 MEN1 (0.32)
SCHEMBL27312707 0.61 POLB (0.34) CRHBPCRHR2NUDT1POLB
SCHEMBL27522764 0.59
SCHEMBL9253837 0.59 CYP1A2 (0.35) CRHBPCRHR2NUDT1
SCHEMBL17822437 0.56 NUDT1 (0.50) CRHBPCRHR2NUDT1POLB
SCHEMBL2089785 0.54 FLT3 (0.47) CRHBPCRHR2HSD17B10

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
CN-1051173-A new triazolyl hydrazide derivative and preparation method thereof EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1991-05-08 CN disclosed