SCHEMBL7623286

SCHEMBL7623286

Cc1cc(Cl)cc2[nH][c]nc12

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.33
▸ PRKCZ Q05513 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CES1 P23141 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
SCHEMBL3648817 0.80 HSD17B10 (0.35) ALDH1A1
SCHEMBL8564324 0.80 HTT (0.44) HTTADORA3ADORA1EGLN1ALDH1A1
SCHEMBL7617376 0.72 HTT (0.30) HTT
SCHEMBL6032862 0.69 PDE3B (0.30) —
SCHEMBL558087 0.68 MGAM (0.39) —
SCHEMBL18894088 0.67 NOTUM (0.31) —
SCHEMBL18894149 0.67 GRIN2D (0.32) —
SCHEMBL13898339 0.67 MEN1 (0.44) HTTADORA3ADORA1ALDH1A1SMN1; SMN2
SCHEMBL29804799 0.67 MEN1 (0.44) HTTADORA3ADORA1ALDH1A1SMN1; SMN2
SCHEMBL14468054 0.67 HTT (0.39) HTTADORA3ADORA1EGLN1PRKCZ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1232166-A2 SYNTHESIS OF 2'-DEOXY-L-NUCLEOSIDES Pharmasset Limited (US) 2002-08-21 — — EP disclosed
WO-2001034618-A2 SYNTHESIS OF 2'-DEOXY-L-NUCLEOSIDES PHARMASSET LIMITED (US) 2001-05-17 — — WO disclosed
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