SCHEMBL27364196

SCHEMBL27364196

CCc1cc2cc(NC(=N)N)ccc2n1C(CC)CC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 4/20 0.41
▸ PLAU P00749 2/20 0.33
▸ F2 P00734 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAT P00750 1/20 0.33
▸ KLKB1 P03952 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ SLC2A1 P11166 2/20 0.31
▸ RAB9A P51151 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
SCHEMBL9568529 0.82 DHFR (0.35) DHFR
SCHEMBL27364194 0.74 PLAU (0.44) DHFRPLAUBACE1SLC2A1
SCHEMBL3772999 0.65 GRIN2D (0.58) PLAUF2PLGPLATKLKB1
SCHEMBL16175487 0.64 MAPT (0.56) RAB9A
SCHEMBL12501310 0.62 L3MBTL1 (0.60) RAB9A
SCHEMBL8741155 0.61 TSHR (0.43) PLAUF2PLGPLATKLKB1
SCHEMBL10310301 0.61 NPSR1 (0.69) RAB9A
SCHEMBL9543474 0.61 DHFR (0.34) DHFRSLC2A1
SCHEMBL1996357 0.61 SIGMAR1 (0.57) PLAUF2PLGKLKB1PRSS1
SCHEMBL8269124 0.60 SIGMAR1 (0.60) —

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-1073175-A Heterogeneous ring compound WELLCOME FOUND (GB) 1993-06-16 — — CN disclosed
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