SCHEMBL7337955

SCHEMBL7337955

Cc1cc(C(=O)OS(=O)(=O)Cc2ccc3cc(C(=N)N)ccc3c2)ccc1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ PRSS1 P07477 5/20 0.40
▸ PLAU P00749 2/20 0.40
▸ F2 P00734 2/20 0.40
▸ PLG P00747 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL7338130 0.84 MAPT (0.48) MAPTMEN1KMT2APRSS1PLAU
SCHEMBL10915437 0.81 F2 (0.44) MEN1KMT2APRSS1PLAUF2
SCHEMBL7337951 0.80 FTO (0.60) MAPTNPC1RAB9ATSHRMEN1
SCHEMBL10922460 0.80 PLAU (0.54) MAPTPRSS1PLAUF2PLG
SCHEMBL10917873 0.79 PLAU (0.46) PRSS1PLAUF2PLGPLAT
SCHEMBL7347944 0.78 PLAU (0.44) MAPTNPC1TSHRPRSS1PLAU
SCHEMBL10938176 0.78 PLAU (0.48) PRSS1PLAUF2PLGPLAT
SCHEMBL8147331 0.76 TSHR (0.65) MAPTNPC1RAB9ATSHRMEN1
SCHEMBL27816977 0.76 PLAU (0.55) PRSS1PLAUF2PLGPLAT
SCHEMBL10738973 0.74 PLAU (0.42) PRSS1PLAUF2PLGPLAT

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
EP-0048433-B1 NOVEL AMIDINE COMPOUNDS, PROCESS FOR PRODUCING SAME AND ANTI-COMPLEMENT AGENT COMPRISING THEM TORII & CO., LTD. (JP) 1986-05-28 — — EP disclosed
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 — — US disclosed
EP-0048433-A2 Novel amidine compounds, process for producing same and anti-complement agent comprising them TORII & CO., LTD. (JP) 1982-03-31 — — EP disclosed
Send feedback