SCHEMBL7547492

SCHEMBL7547492

N#Cc1cnc([AsH]c2ccc3[nH]ccc3c2)c(N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 1/20 0.48
▸ IMPDH1 P20839 1/20 0.48
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ GABRA4 P48169 1/20 0.41
▸ GABRE P78334 1/20 0.41
▸ GABRA6 Q16445 1/20 0.41
▸ GABRG1 Q8N1C3 1/20 0.41
▸ GABRG3 Q99928 1/20 0.41
▸ GABRQ Q9UN88 1/20 0.41
▸ GFER P55789 1/20 0.38
▸ CYP19A1 P11511 1/20 0.35

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
SCHEMBL7185783 0.73 EGFR (0.53) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL30389000 0.67 IMPDH2 (1.00) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL91366 0.67 IMPDH2 (1.00) IMPDH2IMPDH1GABRPGABRDGABRA1
Hydrochloric Acid SCHEMBL27803164 0.66 IMPDH2 (0.96) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL28194905 0.66 IMPDH2 (0.96) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL5531542 0.65 IMPDH2 (0.44) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL5531535 0.65 IMPDH2 (0.44) IMPDH2IMPDH1GABRPGABRDGABRA1
Pyrimidine SCHEMBL28222789 0.64 IMPDH2 (0.75) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL7369210 0.63 IMPDH2 (0.59) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL298150 0.63 RIPK1 (0.69) IMPDH2IMPDH1RIPK1LRRK2FYN

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-1196391-A1 BENZIMIDAZOLONE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-17 — — EP disclosed
WO-2001005770-A1 BENZIMIDAZOLONE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-25 — — WO disclosed
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