SCHEMBL4244699

SCHEMBL4244699

CCCCn1cc[n+](C)c1C.Cl[Al-](Cl)(Cl)Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
EEF2K O00418 2/20 0.42
EEF2 P13639 2/20 0.42
MEN1 O00255 2/20 0.42
PLK4 O00444 1/20 0.42
JAK2 O60674 1/20 0.42
EGFR P00533 1/20 0.42
TYK2 P29597 1/20 0.42
FLT3 P36888 1/20 0.42
BLM P54132 1/20 0.42
ITK Q08881 1/20 0.42
PIM2 Q9P1W9 1/20 0.42
CA1 P00915 5/20 0.42
CA2 P00918 5/20 0.42
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
ACHE P22303 2/20 0.39
HDAC8 Q9BY41 1/20 0.34
APAF1 O14727 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL28385710 0.93 KMT2A (0.46) KMT2AEEF2KEEF2MEN1PLK4
SCHEMBL294425 0.93 KMT2A (0.46) KMT2AEEF2KEEF2MEN1PLK4
Hydrochloric Acid SCHEMBL295048 0.91 KMT2A (0.47) KMT2AEEF2KEEF2MEN1PLK4
Fluoride Ion SCHEMBL1537051 0.91 KMT2A (0.45) KMT2AEEF2KEEF2MEN1PLK4
Bromide SCHEMBL711969 0.91 CA1 (0.49) KMT2AEEF2KEEF2MEN1PLK4
Iodide SCHEMBL596677 0.91 EEF2K (0.48) KMT2AEEF2KEEF2MEN1PLK4
Water SCHEMBL7031552 0.91 KMT2A (0.45) KMT2AEEF2KEEF2MEN1PLK4
SCHEMBL4263817 0.90 KMT2A (0.42) KMT2AEEF2KEEF2MEN1PLK4
SCHEMBL15732265 0.89 ACHE (0.41) KMT2AEEF2KEEF2MEN1PLK4
SCHEMBL5797606 0.88 KMT2A (0.43) KMT2AEEF2KEEF2MEN1PLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812382-B1 METHOD FOR PRODUCING POLYISOCYANATES BASF SE (DE) 2013-01-23 EP claimed
US-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESSELLSCHAFT (DE) 2009-04-30 US claimed
CN-111836849-B Process for producing fibers, films and moldings of polybenzazole polymer (P) 巴斯夫欧洲公司 2023-04-07 CN disclosed
EP-3512905-B1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2022-08-24 EP disclosed
CN-109790292-B Process for preparing polybenzazole polymer (P) 巴斯夫欧洲公司 2022-05-31 CN disclosed
EP-3762447-A1 METHOD FOR PRODUCING FIBRES, FILMS AND MOULDED BODIES OF A POLYBENZAZOLE POLYMER (P) BASF SE (DE) 2021-01-13 EP disclosed
US-20200407508-A1 METHOD FOR PRODUCING FIBERS, FILMS AND MOLDINGS OF A POLYBENZAZOLE POLYMER (P) BASF SE (DE) 2020-12-31 US disclosed
CN-111836849-A Process for producing fibers, films and moldings of polybenzazole polymer (P) 巴斯夫欧洲公司 2020-10-27 CN disclosed
WO-2019170529-A1 METHOD FOR PRODUCING FIBRES, FILMS AND MOULDED BODIES OF A POLYBENZAZOLE POLYMER (P) BASF SE (DE) 2019-09-12 WO disclosed
EP-2736114-B1 ALUMINUM-HALOGEN FUEL CELL NIPPON SODA CO (JP) 2018-04-18 EP disclosed
US-20160190608-A1 ALUMINUM-HALOGEN FUEL CELL Ueda, Mikito (JP) 2016-06-30 US disclosed
US-9368848-B2 Aluminum-halogen fuel cell Nippon Soda Ltd., Co. (JP) 2016-06-14 US disclosed
US-20140178796-A1 ALUMINUM-HALOGEN FUEL CELL NIPPON SODA CO., LTD. (JP) 2014-06-26 US disclosed
EP-2736114-A1 ALUMINUM-HALOGEN FUEL CELL Nippon Soda Co., Ltd. (JP) 2014-05-28 EP disclosed
US-7897806-B2 Reacting primary amines with phosgene in ionic liquid as solvent BASF AKTIENGESELLSCHAFT (DE) 2011-03-01 US disclosed
US-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES BASF AKTIENGESSELLSCHAFT (DE) 2009-04-30 US disclosed
US-7161022-B2 Process for producing 4-phenyl-4-oxo-2-butenoic ester derivative FUJIFILM FINECHEMICALS CO., LTD. (JP) 2007-01-09 US disclosed
US-20050176994-A1 Process for producing 4-phenyl-4-oxo-2-butenoic ester derivative SANKIO CHEMICAL CO., LTD. (JP) 2005-08-11 US disclosed
EP-1505054-A1 PROCESS FOR PRODUCING 4-PHENYL-4-OXO-2-BUTENOIC ESTER DERIVATIVE Sankio Chemical Co., Ltd. (JP) 2005-02-09 EP 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 (2 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-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES PGLS, INMT, PNMT KMT2A 1556/4885EEF2K 3495/4885EEF2 2814/4885
US-20050176994-A1 Process for producing 4-phenyl-4-oxo-2-butenoic ester derivative HPD, PAH, CYP4A11 KMT2A 1717/4885EEF2K 2552/4885EEF2 2545/4885

“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.