SCHEMBL27687135

SCHEMBL27687135

O=C(O)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 4/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.60
▸ POLB P06746 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.59
▸ MAPT P10636 5/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ CYP1A2 P05177 1/20 0.57
▸ CYP2D6 P10635 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ STAT3 P40763 2/20 0.57
▸ LMNA P02545 2/20 0.57
▸ GRN P28799 2/20 0.56
▸ SORT1 Q99523 2/20 0.56
▸ MALT1 Q9UDY8 1/20 0.52
▸ TP53 P04637 1/20 0.51
▸ MME P08473 1/20 0.49
▸ GALR3 O60755 1/20 0.49
▸ GAA P10253 1/20 0.49

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
SCHEMBL27687138 0.91 SMN1; SMN2 (0.69) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL27706388 0.88 GRN (0.56) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL27706390 0.87 MAPT (0.56) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL4689814 0.84 GRN (0.64) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL8589911 0.84 SMN1; SMN2 (0.54) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL7901219 0.83 MAPT (0.59) MARS1SMN1; SMN2POLBTDP1MAPT
SCHEMBL8367181 0.83 MARS1 (0.65) MARS1SMN1; SMN2MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL8364783 0.82 MARS1 (0.64) MARS1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL117500 0.80 MARS1 (1.00) MARS1SMN1; SMN2POLBTDP1
SCHEMBL117660 0.80 MARS1 (1.00) MARS1SMN1; SMN2POLBTDP1

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
CN-102274214-B Medicinal use of (E)-N-furanylmethylene-1-benzyl-3-(4-chlorphenyl)-1H-pyrazol-5-carbohydrazide UNIV SHANDONG 2013-07-10 — — CN disclosed
CN-102274214-A Medicinal use of (E)-N-furanylmethylene-1-benzyl-3-(4-chlorphenyl)-1H-pyrazol-5-carbohydrazide — 2011-12-14 — — CN disclosed
CN-101121711-A Pyrazolcarbazone derivatives and application thereof UNIV SHANDONG (CN) 2008-02-13 — — CN disclosed
CN-101085758-A 1-arylmethyl-3-aryl-1H-pyrazole-5-carbohydrazide derivative, preparation method and application thereof UNIV SHANDONG (CN) 2007-12-12 — — CN disclosed
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