SCHEMBL7933008

SCHEMBL7933008

COC(=O)c1ccc([NH])c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.62
▸ KMT2A Q03164 5/20 0.55
▸ CA1 P00915 4/20 0.52
▸ CA2 P00918 4/20 0.52
▸ CA12 O43570 3/20 0.52
▸ CA7 P43166 3/20 0.52
▸ CA9 Q16790 3/20 0.52
▸ CA14 Q9ULX7 3/20 0.52
▸ XDH P47989 1/20 0.52
▸ TSHR P16473 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ ATM Q13315 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 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
SCHEMBL1807024 0.83 CA1 (0.69) CA1CA2CA12CA7CA9
Veratric Acid Methyl Ester SCHEMBL2050732 0.82 MAPT (0.86) MAPTKMT2ACA1CA2CA12
Veratric Acid Methyl Ester SCHEMBL29573244 0.82 MAPT (0.86) MAPTKMT2ACA1CA2CA12
SCHEMBL10504331 0.82 PLK1 (0.53) MAPTKMT2ACA1CA2CA12
SCHEMBL1804669 0.81 MAPK1 (0.58) MAPTKMT2ACA1CA2CA12
SCHEMBL31238850 0.81 MAPT (0.66) MAPTKMT2ACA1CA2CA12
SCHEMBL7927352 0.79 TDP1 (0.53) MAPTKMT2ACA1CA2CA12
SCHEMBL1898028 0.79 CA1 (0.69) MAPTKMT2ACA1CA2CA12
Methyl Vanillate SCHEMBL25417789 0.79 KMT2A (0.72) MAPTKMT2ACA1CA2CA12
SCHEMBL2892480 0.79 MAPT (0.64) MAPTKMT2ACA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 — — EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 — — US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 — — US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 — — EP disclosed
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