SCHEMBL11293385

SCHEMBL11293385

N#Cc1ccc2nc(-c3ccc(-c4nc5ccc(C#N)cc5[nH]4)s3)[nH]c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKN1 Q16512 1/20 0.62
▸ PKN2 Q16513 1/20 0.62
▸ METAP2 P50579 1/20 0.58
▸ METAP1 P53582 1/20 0.58
▸ CHEK2 O96017 2/20 0.54
▸ PIN1 Q13526 1/20 0.52
▸ CSNK1D P48730 6/20 0.49
▸ CSNK1A1 P48729 5/20 0.49
▸ GSK3B P49841 4/20 0.49
▸ CSNK1G2 P78368 4/20 0.49
▸ DGAT1 O75907 1/20 0.49
▸ SOAT1 P35610 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ RHEB Q15382 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ RAB9A P51151 2/20 0.45

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
SCHEMBL11293382 0.88 PKN1 (0.48) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL20982510 0.82 PKN1 (0.82) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL8344485 0.79 RHEB (0.49) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL18764054 0.78 CHEK2 (0.78) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL14816640 0.76 PKN1 (0.72) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL3341423 0.76 PKN1 (0.72) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL1253278 0.75 PKN1 (0.58) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL23563056 0.74 PKN1 (0.68) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL20550741 0.74 ALOX5 (0.64) PKN1PKN2METAP2METAP1CHEK2
SCHEMBL10188885 0.74 PKN1 (0.57) PKN1PKN2METAP2METAP1CHEK2

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-0009163-B1 Substituted bisbenzimidazole derivatives, their preparation and antiprotozoic and antiviral agents HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-30 — — EP disclosed
EP-0009163-A2 Substituted bisbenzimidazole derivatives, their preparation and antiprotozoic and antiviral agents HOECHST AKTIENGESELLSCHAFT (DE) 1980-04-02 — — EP disclosed
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