SCHEMBL4245376

SCHEMBL4245376

CC[n+]1ccn(C)c1C.Cl[Al-](Cl)(Cl)Cl

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
POLB P06746 1/20 0.33
APOBEC3A P31941 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
MEN1 O00255 1/20 0.30
EEF2K O00418 1/20 0.30
PLK4 O00444 1/20 0.30
JAK2 O60674 1/20 0.30
EGFR P00533 1/20 0.30
EEF2 P13639 1/20 0.30
TYK2 P29597 1/20 0.30
FLT3 P36888 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
ITK Q08881 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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
SCHEMBL294563 0.92
SCHEMBL28238038 0.92 CTDSP1 (0.36) HDAC8CA1CA2POLBAPOBEC3A
Fluoride Ion SCHEMBL1900591 0.90 CTDSP1 (0.35) HDAC8CA1CA2POLBAPOBEC3A
Hydrochloric Acid SCHEMBL385497 0.90 CTDSP1 (0.35) HDAC8CA1CA2POLBAPOBEC3A
Iodide SCHEMBL2037552 0.90 CTDSP1 (0.39) HDAC8CA1CA2POLBAPOBEC3A
Bromide SCHEMBL710393 0.90 CA1 (0.39) HDAC8CA1CA2POLBAPOBEC3A
Water SCHEMBL15361632 0.90 CTDSP1 (0.35) HDAC8CA1CA2POLBAPOBEC3A
SCHEMBL6649711 0.88 CA1 (0.33) HDAC8CA1CA2POLBAPOBEC3A
SCHEMBL15732264 0.86 CA1 (0.38) HDAC8CA1CA2MEN1EEF2K
SCHEMBL384801 0.84 CA1 (0.33) HDAC8CA1CA2POLBAPOBEC3A

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 16 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

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-20090112017-A1 METHOD FOR PRODUCING POLYISOCYANATES PGLS, INMT, PNMT HDAC8 4486/4885CA1 2478/4885CA2 2076/4885

“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.