SCHEMBL5729294

SCHEMBL5729294

Cc1cc(N2CCC(NN3CCN(S(=O)(=O)c4ccc5cc(Cl)ccc5c4)CC3=O)CC2)ccn1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.51
F2 P00734 1/20 0.51
PLAT P00750 1/20 0.51
KLKB1 P03952 1/20 0.51
KDM4E B2RXH2 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LDHA P00338 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38

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
Hydrochloric Acid SCHEMBL5729622 0.99 F10 (0.51) F10F2PLATKLKB1KDM4E
SCHEMBL5729098 0.89 F10 (0.61) F10
Hydrochloric Acid SCHEMBL5729796 0.88 F10 (0.61) F10
SCHEMBL5729588 0.84 F10 (0.51) F10F2PLATKLKB1KDM4E
SCHEMBL5729414 0.84 F10 (0.51) F10SMN1; SMN2HTT
SCHEMBL5728845 0.83 F10 (0.58) F10F2PLATKLKB1KDM4E
SCHEMBL5731177 0.83 F10 (0.49) F10F2PLATKLKB1
SCHEMBL5729659 0.83 F10 (0.43) F10F2KDM4ESMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL5728947 0.83 F10 (0.57) F10F2PLATKLKB1KDM4E
SCHEMBL5729785 0.82 F10 (0.50) F10F2PLATKLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1188755-B1 ACYLHYDRAZINE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-05-03 EP disclosed
US-6723722-B1 BLOOD COAGULATION FACTOR X INHIBITORS; ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-20 US disclosed
EP-1188755-A1 ACYLHYDRAZINE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2002-03-20 EP disclosed