SCHEMBL7651333

SCHEMBL7651333

CN(O)C(=O)c1ccccc1-c1ccccc1C(=O)Nc1ccc(C(=N)N)cc1.CS(=O)(=O)O

nearest known ligand 0.55

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 known ✓ P00734 7/20 0.55
F10 P00742 9/20 0.55
PLAU P00749 7/20 0.55
PLAT P00750 7/20 0.55
PLG P00747 4/20 0.55
PRSS1 P07477 3/20 0.52
PRSS2 P07478 3/20 0.52
PRSS3 P35030 3/20 0.52
F7 P08709 1/20 0.52
F3 P13726 1/20 0.52
KLK1 P06870 5/20 0.51
KLK5 Q9Y337 5/20 0.51
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL7657582 0.95 F10 (0.60) F10PLAUPLATF2PLG
SCHEMBL7663108 0.86 F10 (0.64) F10PLAUPLATF2PLG
SCHEMBL7651338 0.86 F10 (0.52) F10PLAUPLATF2PLG
SCHEMBL7662256 0.83 F3 (0.64) F10PLAUPLATF2PLG
SCHEMBL7664211 0.82 F10 (0.55) F10PLAUPLATF2PLG
SCHEMBL7665020 0.81 F2 (0.59) F10PLAUPLATF2PLG
SCHEMBL7660883 0.81 F2 (0.70) F10PLAUPLATF2PLG
SCHEMBL7659139 0.81 PLAU (0.58) F10PLAUPLATF2PLG
SCHEMBL7663117 0.81 F10 (0.56) F10PLAUPLATF2PLG
SCHEMBL7656744 0.81 PLAU (0.64) F10PLAUPLATF2PLG

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
US-6358960-B1 FOR THERAPY OF INTRAVASCULAR COAGULATION, CORONARY THROMBOSIS, CEREBRAL INFARCTION, CEREBRAL EMBOLISM, TRANSIENT ISCHEMIC ATTACK, CEREBROVASCULAR DISORDERS, PULMONARY VASCULAR DISEASES, DEEP VENOUS THROMBOSIS, ETC. ONO PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed
EP-1078917-A1 AMIDINO DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-02-28 EP disclosed