SCHEMBL7208898

SCHEMBL7208898

Clc1cc2[nH]c(NC3CC3)nc2c(Br)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 12/20 0.45
▸ RIPK1 Q13546 3/20 0.43
▸ EGLN1 Q9GZT9 1/20 0.39
▸ BRD4 O60885 1/20 0.37
▸ PTGES O14684 1/20 0.33
▸ KCNN1 Q92952 1/20 0.32
▸ KCNN2 Q9H2S1 1/20 0.32
▸ KCNN3 Q9UGI6 1/20 0.32
▸ RHEB Q15382 1/20 0.32

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
SCHEMBL7214221 0.87 RIPK1 (0.46) PIM1RIPK1EGLN1BRD4PTGES
SCHEMBL7903051 0.75 CSNK2A2 (0.49) PIM1RIPK1EGLN1RHEB
SCHEMBL7208984 0.74 RIPK1 (0.58) RIPK1EGLN1KCNN1KCNN2KCNN3
SCHEMBL7742250 0.73 EGLN1 (0.47) EGLN1RHEB
SCHEMBL7734320 0.73 EGLN1 (0.47) EGLN1RHEB
SCHEMBL8369973 0.70 CYP1A2 (0.47) —
SCHEMBL8369927 0.66 CYP1A2 (0.46) RIPK1
SCHEMBL20536034 0.64 RHEB (0.76) PIM1EGLN1RHEB
SCHEMBL10323028 0.62 PIM1 (1.00) PIM1
SCHEMBL10323530 0.62 PIM1 (1.00) PIM1

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
US-6617315-B1 Sugar-substituted benzimidazole derivatives are used for the treatment or prophylaxis of restenosis, particularly following angioplasty CHAMBERLAIN STANLEY DAWES (US) 2003-09-09 — — US disclosed
US-6204249-B1 L-benzimidazole nucleosides GLAXO WELLCOME INC. 2001-03-20 — — US disclosed
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