SCHEMBL9835889

SCHEMBL9835889

CCS(=O)(=O)Oc1cc(Cl)cc(OC(=O)c2ccc(NC(=N)N)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
PRSS1 P07477 3/20 0.38
F2 P00734 2/20 0.38
KLKB1 P03952 2/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
PLAT P00750 1/20 0.38
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
ENPP2 Q13822 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
ACR P10323 1/20 0.38
FTO Q9C0B1 1/20 0.37
MAPT P10636 1/20 0.36

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
Acetic Acid SCHEMBL7314947 0.97 KMT2A (0.45) KMT2AMEN1SMN1; SMN2CA12CA1
SCHEMBL7319785 0.89 KMT2A (0.46) KMT2AMEN1SMN1; SMN2CA12CA1
SCHEMBL7319794 0.86 KMT2A (0.50) KMT2AMEN1SMN1; SMN2PRSS1F2
SCHEMBL7340814 0.85 KMT2A (0.44) KMT2AMEN1SMN1; SMN2CA12CA1
SCHEMBL7319782 0.82 KMT2A (0.46) KMT2AMEN1SMN1; SMN2PRSS1F2
SCHEMBL9584464 0.81 ALDH1A1 (0.45) KMT2AMEN1SMN1; SMN2CA12CA1
SCHEMBL9835061 0.80 KMT2A (0.48) KMT2AMEN1SMN1; SMN2PRSS1F2
SCHEMBL9690496 0.80 KMT2A (0.42) KMT2AMEN1SMN1; SMN2PRSS1F2
SCHEMBL9690520 0.79 KMT2A (0.45) KMT2AMEN1SMN1; SMN2PRSS1F2
SCHEMBL9689310 0.79 PPARG (0.50) KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0222608-B1 DERIVATIVES OF P-GUANIDINOBENZOIC ACID AND PHARMACEUTICAL AGENTS CONTAINING THEM AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1991-09-11 EP claimed
EP-0222608-A2 Derivatives of p-guanidinobenzoic acid and pharmaceutical agents containing them as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 1987-05-20 EP claimed