SCHEMBL11218740

SCHEMBL11218740

O=C(O)c1c(C(=O)O)n(-c2cc(Cl)cc(Cl)c2)c(=O)[nH]c1=O.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 1/20 0.40
▸ NOTUM Q6P988 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TPMT P51580 1/20 0.35
▸ ALKBH5 Q6P6C2 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31

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
Water SCHEMBL10961868 0.98 MAT2A (0.39) MAT2ANOTUMNPSR1TPMTALKBH5
Water SCHEMBL11252650 0.97 MAT2A (0.40) MAT2ANOTUMNPSR1TPMTALKBH5
SCHEMBL11171270 0.97 MAT2A (0.40) MAT2ANOTUMNPSR1TPMTALKBH5
SCHEMBL11170757 0.88 NOTUM (0.40) MAT2ANOTUMNPSR1TPMTMAPT
SCHEMBL11218737 0.87 MAT2A (0.38) MAT2ANOTUMNPSR1TPMTMAPT
Lithium Ion SCHEMBL11171268 0.87 MAT2A (0.38) MAT2ANOTUMNPSR1TPMTMAPT
SCHEMBL11037703 0.87 NPSR1 (0.50) MAT2ANOTUMNPSR1ALKBH5MAPT
Water SCHEMBL10961864 0.86 MAT2A (0.37) MAT2ANOTUMNPSR1TPMTMAPT
Water SCHEMBL10962459 0.85 NPSR1 (0.49) MAT2ANOTUMNPSR1ALKBH5MAPT
SCHEMBL10963182 0.85 MAT2A (0.46) MAT2ANPSR1MAPTKMT2ATSHR

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-4400508-A AGRICULTURE; PLANT DISEASES; ANTISEPTICS UBE INDUSTRIES, LTD. (JP) 1983-08-23 — — US claimed
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