SCHEMBL5452318

SCHEMBL5452318

CC(=O)c1ccc(C(=O)NN)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.64
CYP3A4 P08684 2/20 0.64
KDM5A P29375 1/20 0.64
BLM P54132 1/20 0.64
GFER P55789 1/20 0.64
PMP22 Q01453 1/20 0.64
HIF1A Q16665 1/20 0.64
MAPT P10636 6/20 0.63
ALDH1A1 P00352 4/20 0.61
KDM4E B2RXH2 3/20 0.61
L3MBTL1 Q9Y468 3/20 0.61
LMNA P02545 2/20 0.61
OGG1 O15527 1/20 0.61
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CYP1A2 P05177 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2A6 P11509 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL2678949 0.87 MPO (0.80) MPOCYP3A4KDM5ABLMGFER
SCHEMBL343630 0.87 MPO (0.80) MPOCYP3A4KDM5ABLMGFER
SCHEMBL28188923 0.85 MPO (0.76) MPOCYP3A4KDM5ABLMGFER
SCHEMBL12947945 0.82 MPO (0.59) MPOCYP3A4KDM5ABLMGFER
SCHEMBL136524 0.81 ALDH1A1 (0.67) MPOCYP3A4KDM5ABLMGFER
SCHEMBL11134828 0.80 MPO (0.70) MPOCYP3A4KDM5ABLMGFER
SCHEMBL752600 0.80 MPO (0.70) MPOCYP3A4KDM5ABLMGFER
SCHEMBL12893241 0.79 GAA (0.61) MAPTALDH1A1L3MBTL1LMNAKMT2A
Hydrochloric Acid SCHEMBL29286645 0.79 ALDH1A1 (0.64) MPOCYP3A4KDM5ABLMGFER
Benzoic Acid Hydrazide SCHEMBL3586552 0.79 CYP3A4 (0.56) MPOCYP3A4KDM5ABLMGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155924-A1 Starter systems II COGNIS DEUTSCHLAND GMBH & CO. KG (DE) 2007-07-05 US claimed
EP-1622945-A1 STARTER SYSTEMS II Cognis Deutschland GmbH & Co. KG (DE) 2006-02-08 EP claimed
WO-2004099263-A1 STARTER SYSTEMS II COGNIS DEUTSCHLAND GMBH & CO. KG (DE) 2004-11-18 WO claimed
CN-115068591-B Probiotic composition containing osteopontin 合生元(广州)健康产品有限公司 2023-03-17 CN disclosed
CN-111057065-B Preparation method and application of thienopyrimidine compound 沈阳药科大学 2021-04-23 CN disclosed
CN-111057065-A Preparation method and application of thienopyrimidine compound 沈阳药科大学 2020-04-24 CN disclosed
US-20070155924-A1 Starter systems II COGNIS DEUTSCHLAND GMBH & CO. KG (DE) 2007-07-05 US disclosed
EP-1622945-A1 STARTER SYSTEMS II Cognis Deutschland GmbH & Co. KG (DE) 2006-02-08 EP disclosed
WO-2004099263-A1 STARTER SYSTEMS II COGNIS DEUTSCHLAND GMBH & CO. KG (DE) 2004-11-18 WO disclosed
US-5086052-A Antiarthritic, antiallergens, antiinflammatory agents; also for asthma and psoriasis ABBOTT LABORATORIES (US) 1992-02-04 US disclosed
US-4970210-A ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1990-11-13 US disclosed
EP-0299449-A2 Pyridazinone, triazinone and oxapyridazinone lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-01-18 EP disclosed
US-4263396-A Direct-positive photographic material AGFA-GEVAERT AG (DE) 1981-04-21 US disclosed