SCHEMBL6084716

SCHEMBL6084716

CC(C)(C)OC(=O)CNC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 2/20 0.62
PRSS1 P07477 2/20 0.55
CTSG P08311 2/20 0.55
CTRB1 P17538 2/20 0.55
CMA1 P23946 2/20 0.55
GAA P10253 1/20 0.53
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
GLA P06280 1/20 0.49
ESRRG P62508 1/20 0.49
GPR139 Q6DWJ6 1/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL24224237 0.88 PTPRC (0.57) PTPRCPRSS1CTSGCTRB1CMA1
SCHEMBL27453159 0.85 PRSS1 (0.69) PTPRCPRSS1CTSGCTRB1CMA1
SCHEMBL14427898 0.85 PRSS1 (0.51) PTPRCPRSS1CTSGCTRB1CMA1
SCHEMBL13605087 0.85 PTPRC (0.57) PTPRCRAB9ANPC1LMNASMN1; SMN2
SCHEMBL834521 0.85 PTPRC (0.57) PTPRCKDM4ERAB9ANPC1ESRRG
SCHEMBL12301492 0.85 TDP1 (0.65) PTPRCGAARAB9ANPC1LMNA
SCHEMBL25366312 0.84 PTPRC (0.57) PTPRCPKMRAB9ANPC1GPR139
SCHEMBL3961994 0.84 GAA (0.59) PRSS1CTSGCTRB1CMA1GAA
SCHEMBL6085598 0.83 PTPRC (0.49) PTPRCPRSS1CTSGCTRB1CMA1
SCHEMBL30572070 0.83 KMT2A (0.56) PTPRCRAB9ANPC1SMN1; SMN2L3MBTL1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101945852-A Azetidine derivatives, their preparation and their use in therapy SANOFI AVENTIS 2011-01-12 CN claimed
CN-101945852-A Azetidine derivatives, their preparation and their use in therapy SANOFI AVENTIS 2011-01-12 CN disclosed
CN-1688600-B Template-fixed peptidomimetics with antibacterial activity POLYPHOR LTD 2010-04-28 CN disclosed
EP-1757582-A1 ARYLALKYLAMINES AND PROCESS FOR PRODUCTION THEREOF TANABE SEIYAKU CO., LTD. (JP) 2007-02-28 EP disclosed
US-7015223-B1 Substituted polycyclic aryl and heteroaryl 1,2,4-triazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2006-03-21 US disclosed
CN-1688600-A Template-fixed peptidomimetics with antibacterial activity POLYPHOR LTD (CH) 2005-10-26 CN disclosed
US-6906068-B1 Substituted polycyclic aryl and heteroaryl 1,2,4 - triazinones useful as anticoagulants PHARMACIA CORPORATION (US) 2005-06-14 US disclosed
US-20050054643-A1 Substituted polycyclic aryl and heteroaryl pyrimidinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2005-03-10 US disclosed
EP-1458747-A1 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF SERINE PROTEASES Polyphor Ltd. (CH) 2004-09-22 EP disclosed
CN-1157380-C Substituted polycyclic aryl and heteroaryl pyrymidinones useful as anticoagulants agents �ź㴫 2004-07-14 CN disclosed
US-6750342-B1 INHIBITORS OF SERINE PROTEASES; ANTICOAGULANT PHARMACIA CORPORATION 2004-06-15 US disclosed
US-6653316-B1 Coronary artery and cerebrovascular diseases PHARMACIA CORPORATION 2003-11-25 US disclosed
WO-2003054000-A1 TEMPLATE-FIXED PEPTIDOMIMETICSAS INHIBITORS OF SERINE PROTEASES POLYPHOR LTD. (CH) 2003-07-03 WO disclosed
CN-1351593-A Substituted polycyclic aryl and heteroaryl pyrymidinones useful as anticoagulants agents PHARMACIA CO (US) 2002-05-29 CN disclosed
EP-1178970-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRYMIDINONES USEFUL AS ANTICOAGULANTS Pharmacia Corporation (US) 2002-02-13 EP disclosed
WO-2001087851-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRIMIDINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 WO disclosed
WO-2000069832-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRYMIDINONES USEFUL AS ANTICOAGULANTS PHARMACIA CORPORATION (US) 2000-11-23 WO disclosed
CN-1041919-C N-(3-piperidinylcarbonyl)-beta-alanine derivatives as PAF antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1999-02-03 CN disclosed
CN-1116847-A N- (3-piperidinylcarbonyl) -beta-aminopropionic acid derivatives as PAF antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1996-02-14 CN disclosed
US-5212158-A Nootropic agents INORGAN SA RECHERCHE & DEVELOPPEMENT PHARMACEUTIQUES, CAS (CH) 1993-05-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050054643-A1 Substituted polycyclic aryl and heteroaryl pyrimidinones useful for selective inhibition of the coagulation cascade TFPI, PLAT, SERPINC1 PTPRC 1290/4885PRSS1 7/4885CTSG 278/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.