SCHEMBL27706388

SCHEMBL27706388

O=C(O)c1cc(-c2ccc(Cl)cc2)nn1CCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRN P28799 1/20 0.56
▸ SORT1 Q99523 1/20 0.56
▸ LMNA P02545 2/20 0.54
▸ MARS1 P56192 3/20 0.53
▸ PRCP P42785 2/20 0.51
▸ TP53 P04637 2/20 0.50
▸ MDM2 Q00987 2/20 0.50
▸ MAPT P10636 4/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ STAT3 P40763 1/20 0.47
▸ CTRC Q99895 1/20 0.44
▸ USP2 O75604 1/20 0.44

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
SCHEMBL27687135 0.88 MARS1 (0.65) GRNSORT1LMNAMARS1TP53
SCHEMBL27694051 0.88 LMNA (0.53) GRNSORT1LMNAMARS1PRCP
SCHEMBL4689445 0.84 GRN (0.66) GRNSORT1LMNATP53MDM2
SCHEMBL24035609 0.80 LMNA (0.69) LMNAPRCPTP53CYP1A2CYP2C9
SCHEMBL27687138 0.79 SMN1; SMN2 (0.69) GRNSORT1LMNAMARS1TP53
SCHEMBL28760198 0.77 MARS1 (0.48) LMNAMARS1TP53MDM2MAPT
SCHEMBL27706390 0.76 MAPT (0.56) LMNAMARS1TP53MAPTMEN1
SCHEMBL596066 0.75 SMN1; SMN2 (0.53) GRNSORT1MARS1TP53MAPT
SCHEMBL2565586 0.75 MAPT (0.56) GRNSORT1LMNAMARS1TP53
SCHEMBL8367181 0.74 MARS1 (0.65) LMNAMARS1TP53MAPTMEN1

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
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
Send feedback