SCHEMBL10936562

SCHEMBL10936562

N=C(N)c1ccc2cc(OC(=O)CC3=CCCC3)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F12 P00748 13/20 0.46
▸ PRSS1 P07477 4/20 0.46
▸ F2 P00734 4/20 0.46
▸ PLG P00747 4/20 0.46
▸ F10 P00742 2/20 0.46
▸ KLK1 P06870 2/20 0.46
▸ TMPRSS2 O15393 1/20 0.46
▸ MLNR O43193 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ C1R P00736 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ ITGB3 P05106 1/20 0.46
▸ HPN P05981 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ ITGA2B P08514 1/20 0.46
▸ C1S P09871 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ DRD2 P14416 1/20 0.46

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
SCHEMBL10938113 0.79 PLAU (0.40) F12PRSS1F2PLGF10
SCHEMBL7344739 0.76 PLAU (0.68) F12PRSS1F2PLGF10
SCHEMBL10939558 0.73 POLB (0.49) F12PRSS1F2PLGF10
SCHEMBL10934547 0.73 F12 (0.53) F12PRSS1F2PLGF10
SCHEMBL10940056 0.72 F12 (0.52) F12PRSS1F2PLGF10
SCHEMBL31499213 0.72 F12 (0.61) F12PRSS1F2PLGF10
SCHEMBL10802088 0.71 GAA (0.42) ALDH1A1LMNAMAPT
SCHEMBL7339708 0.71 PLAU (0.60) F12PRSS1F2PLGF10
SCHEMBL10936549 0.71 F12 (0.46) F12PRSS1F2PLGF10
SCHEMBL10938112 0.70 F12 (0.59) F12PRSS1F2PLGF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4496584-A ANTITRYPSIN, ANTIKALLIKREIN, ANTITHROMBIN OR ANTIPLASMIN AGENT TORII & CO. LTD. (JP) 1985-01-29 — — US disclosed
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