SCHEMBL19447591

SCHEMBL19447591

CNC(=O)C1CN(N)CCN1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 2/20 0.32
▸ GRIN3B O60391 2/20 0.32
▸ THRB P10828 2/20 0.32
▸ GRIN1 Q05586 2/20 0.32
▸ GRIN2A Q12879 2/20 0.32
▸ GRIN2B Q13224 2/20 0.32
▸ GRIN2C Q14957 2/20 0.32
▸ GRIN3A Q8TCU5 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SCN9A Q15858 1/20 0.31
▸ CHRNB2 P17787 2/20 0.31
▸ CHRNA4 P43681 2/20 0.31
▸ CHRNA7 P36544 1/20 0.31
▸ DPP4 P27487 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
SCHEMBL15072877 0.80 CCR2 (0.40) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL2920433 0.80 CCR2 (0.40) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL23459089 0.79 GLI1 (0.36) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL19447676 0.79 GRIN2D (0.32) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL13732366 0.77 SCN9A (0.37) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL15432264 0.77 SCN9A (0.37) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL12312784 0.76 CCR2 (0.43) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL12337422 0.76 CCR2 (0.44) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL15077300 0.76 CCR2 (0.44) GRIN2DGRIN3BTHRBGRIN1GRIN2A
SCHEMBL2912163 0.74 DPP7 (0.35) GRIN2DGRIN3BTHRBGRIN1GRIN2A

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
EP-2794611-B1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES INC (US) 2017-10-11 — — EP disclosed
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