SCHEMBL9853500

SCHEMBL9853500

N=C(N)CC(=O)NN.Nc1ccc(Cl)cc1C(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
GFER P55789 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 4/20 0.46
POLB P06746 1/20 0.46
S100B P04271 1/20 0.45
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
GABRA4 P48169 1/20 0.44
GABRE P78334 1/20 0.44
GABRA6 Q16445 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
SCHEMBL30484136 0.82 RECQL (0.67) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL31000389 0.82 RECQL (0.67) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL145366 0.82 RECQL (0.67) RECQLSMN1; SMN2GFERKMT2AMAPT
Hydrazine SCHEMBL11821861 0.81 RECQL (0.65) RECQLSMN1; SMN2GFERKMT2AMAPT
Hydrochloric Acid SCHEMBL27581315 0.81 RECQL (0.65) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL9853559 0.80 TP53 (0.39) RECQLSMN1; SMN2GFERKMT2AMAPT
Acetamide SCHEMBL16335345 0.80 RECQL (0.59) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL9853575 0.77 RECQL (0.42) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL9853522 0.76 RECQL (0.44) RECQLSMN1; SMN2GFERKMT2AMAPT
SCHEMBL6351799 0.74 RECQL (0.64) RECQLSMN1; SMN2GFERKMT2AMAPT

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
EP-0433526-A1 Medicine for the treatment of heart-circulatory illnesses, of arrhythmics in particular Richter, Peter, Prof. Dr.sc.nat. (DE) 1991-06-26 EP disclosed