SCHEMBL5382890

SCHEMBL5382890

NCCCNc1nc2cnccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.48
▸ TRPC3 Q13507 1/20 0.48
▸ TRPC4 Q9UBN4 1/20 0.48
▸ TRPC5 Q9UL62 1/20 0.48
▸ CHEK1 O14757 2/20 0.47
▸ CHEK2 O96017 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46
▸ LATS1 O95835 4/20 0.43
▸ LATS2 Q9NRM7 3/20 0.43
▸ TSHR P16473 1/20 0.43
▸ KDM4C Q9H3R0 2/20 0.43
▸ PIM1 P11309 2/20 0.41
▸ PRKCH P24723 2/20 0.41
▸ PRKCE Q02156 2/20 0.41
▸ PRKCD Q05655 2/20 0.41
▸ PRKCB P05771 1/20 0.41
▸ PRKCA P17252 1/20 0.41
▸ PRKCQ Q04759 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37

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
SCHEMBL5394585 0.88 CHEK1 (0.50) BCHETRPC3TRPC4TRPC5CHEK1
SCHEMBL6034415 0.80 BCHE (0.72) BCHETRPC3TRPC4TRPC5TDP1
SCHEMBL9240666 0.76 KDM4C (0.39) KDM4CALDH1A1TP53RAB9ASMN1; SMN2
SCHEMBL4640893 0.76 BCHE (0.70) BCHETRPC3TRPC4TRPC5TDP1
SCHEMBL5376933 0.76 PIM1 (0.43) BCHETRPC3TRPC4TRPC5CHEK1
SCHEMBL5383267 0.75 SLC2A1 (0.40) BCHETRPC3TRPC4TRPC5TDP1
SCHEMBL6439777 0.75 BCHE (0.68) BCHETRPC3TRPC4TRPC5TDP1
SCHEMBL6034750 0.73 PIM1 (0.41) BCHETRPC3TRPC4TRPC5CHEK1
SCHEMBL24823072 0.73 LATS1 (0.41) CHEK1CHEK2LATS1LATS2HRH3
SCHEMBL13804704 0.73 PIM1 (0.43) BCHETRPC3TRPC4TRPC5TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213362-A1 2-NH-HETEROARYLIMIDAZOLES WITH ANTIBACTERIAL ACTIVITY REPLIDYNE, INC. (US) 2007-09-13 — — US disclosed
US-7220757-B2 Compositions and methods for topical administration of 2-NH-heteroarylimidazoles REPLIDYNE, INC. (US) 2007-05-22 — — US disclosed
US-20060014748-A1 2-NH-heteroarylimidazoles with antibacterial activity BERGE JOHN 2006-01-19 — — US disclosed
US-6943175-B2 2-NH-heteroarylimidazoles with antibacterial activity REPLIDYNE, INC. (US) 2005-09-13 — — US disclosed
US-20040147548-A1 2-NH-heteroarylimidazoles with antibacterial activity REPLIDYNE, INC. 2004-07-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040147548-A1 2-NH-heteroarylimidazoles with antibacterial activity NSUN3, TRMT1, NOP2 BCHE 2921/4885TRPC3 3042/4885TRPC4 4219/4885
US-20070213362-A1 2-NH-HETEROARYLIMIDAZOLES WITH ANTIBACTERIAL ACTIVITY MET, ASNS, MRPS22 BCHE 1927/4885TRPC3 4800/4885TRPC4 4842/4885
US-20060014748-A1 2-NH-heteroarylimidazoles with antibacterial activity TRMT1, NSUN3, NOP2 BCHE 2752/4885TRPC3 3033/4885TRPC4 4169/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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