SCHEMBL7320953

SCHEMBL7320953

N=C(N)Nc1ccc(C(=O)Oc2ccc(C(=N)N)cc2C(=O)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 5/20 0.45
▸ F2 P00734 5/20 0.44
▸ PLG P00747 4/20 0.44
▸ PLAT P00750 4/20 0.44
▸ PRSS1 P07477 4/20 0.44
▸ KLKB1 P03952 2/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ KMT2A Q03164 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ F10 P00742 3/20 0.41
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ TMPRSS6 Q8IU80 1/20 0.40
▸ ST14 Q9Y5Y6 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ RAB9A P51151 1/20 0.40

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
Bicarbonate SCHEMBL7325582 0.99 PLAU (0.44) PLAUF2PLGPLATPRSS1
SCHEMBL7330969 0.95 FTO (0.42) PLAUF2PLGPLATPRSS1
SCHEMBL11217581 0.95 FTO (0.42) PLAUF2PLGPLATPRSS1
SCHEMBL7323625 0.91 ALDH1A1 (0.52) PLAUF2PLGPLATPRSS1
SCHEMBL7321924 0.90 SLC6A3 (0.47) F2PRSS1KMT2AMAPTSLC6A3
Bicarbonate SCHEMBL7333292 0.89 SLC6A3 (0.46) F2PRSS1KMT2AMAPTSLC6A3
SCHEMBL7323125 0.87 ALDH1A1 (0.48) PLAUF2PLGPLATPRSS1
SCHEMBL7324828 0.86 FTO (0.47) F2PRSS1KLKB1KLK1KMT2A
SCHEMBL7331841 0.85 ESR1 (0.50) KMT2AMAPTLMNAGFERSLC6A3
Bromide SCHEMBL7330269 0.84 ESR1 (0.49) KMT2AMAPTLMNAGFERSLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4514416-A Amidine compound, process for producing same and anti-complement agent comprising same TORII & CO. LTD. (JP) 1985-04-30 — — US claimed
US-4570006-A ANTITHROMBIN; ENZYME AND HORMONE INHIBITORS TORII & CO. LTD. (JP) 1986-02-11 — — US disclosed
US-4514416-A Amidine compound, process for producing same and anti-complement agent comprising same TORII & CO. LTD. (JP) 1985-04-30 — — US disclosed
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