SCHEMBL9751997

SCHEMBL9751997

Cc1cccc2c1OC(C(=O)O)Oc1ccccc1C2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
CASP6 P55212 1/20 0.43
NISCH Q9Y2I1 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ACSL1 P33121 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL10471437 0.86 POLB (0.43) POLBCASP6NISCHL3MBTL1MAOA
SCHEMBL9752013 0.85 KMT2A (0.38) NISCHL3MBTL1MAOAMAOBALDH1A1
SCHEMBL9327125 0.85 POLB (0.56) POLBCASP6NISCHMAOAMAOB
SCHEMBL10473088 0.84 POLB (0.44) POLBCASP6NISCHL3MBTL1MAOA
SCHEMBL10471441 0.84 POLB (0.44) POLBCASP6NISCHMAOAMAOB
SCHEMBL10470737 0.84 POLB (0.41) POLBCASP6NISCHMAOAMAOB
Hydrochloric Acid SCHEMBL9751989 0.83 POLB (0.55) POLBCASP6NISCHMAOAMAOB
SCHEMBL10472308 0.83 POLB (0.43) POLBCASP6NISCHMAOAMAOB
SCHEMBL10470236 0.83 POLB (0.43) POLBCASP6NISCHL3MBTL1MAOA
SCHEMBL10470216 0.83 KDM4E (0.41) POLBCASP6NISCHL3MBTL1ACSL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4979978-A Herbicidal 12H-dibenzo[d,g][1,3]dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1990-12-25 US claimed
EP-0439607-A4 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES 1991-12-04 EP disclosed
EP-0439607-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES ISK BIOSCIENCES CORPORATION (US) 1991-08-07 EP disclosed
WO-1991000009-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES FERMENTA ASC CORPORATION (US) 1991-01-10 WO disclosed
US-4979978-A Herbicidal 12H-dibenzo[d,g][1,3]dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1990-12-25 US disclosed
US-4976770-A POSTEMERGENCE, PREEMERGENCE HERBICIDES FERMENTA ASC CORPORATION (US) 1990-12-11 US disclosed