SCHEMBL7322334

SCHEMBL7322334

N=C(N)c1ccc(OC(=O)c2ccc(OCc3ccccc3)cc2)c(C(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 1/20 0.54
▸ PTGES O14684 1/20 0.52
▸ F2 P00734 6/20 0.51
▸ PRSS1 P07477 1/20 0.51
▸ PRSS2 P07478 1/20 0.51
▸ PRSS3 P35030 1/20 0.51
▸ TMPRSS6 Q8IU80 1/20 0.51
▸ ST14 Q9Y5Y6 1/20 0.51
▸ PARP10 Q53GL7 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ SRD5A2 P31213 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MRGPRX1 Q96LB2 1/20 0.50
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ ITGB3 P05106 1/20 0.47
▸ ITGA2B P08514 1/20 0.47

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
SCHEMBL7332769 0.94 F10 (0.48) F10PTGESF2PRSS1PRSS2
SCHEMBL7321924 0.87 SLC6A3 (0.47) F10F2PRSS1PRSS2PRSS3
Bicarbonate SCHEMBL7333292 0.86 SLC6A3 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL7331841 0.85 ESR1 (0.50) PARP10ALDH1A1SMN1; SMN2GAAMAPT
Bromide SCHEMBL7330269 0.84 ESR1 (0.49) PARP10ALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL10851091 0.81 FTO (0.52) F10F2PRSS1ST14PARP10
SCHEMBL7324828 0.81 FTO (0.47) F10F2PRSS1PARP10ALDH1A1
Methane SCHEMBL11282601 0.80 F2 (0.58) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL10925845 0.79 F2 (0.51) F2MRGPRX1
Acetic Acid SCHEMBL10926648 0.79 ATM (0.51) F10F2MRGPRX1

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-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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