SCHEMBL3261995

SCHEMBL3261995

CCCCCC(CCC)N1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.35
SLC6A3 Q01959 7/20 0.33
SLC6A2 P23975 6/20 0.33
FDPS P14324 4/20 0.33
OPRM1 P35372 1/20 0.33
SLC6A4 P31645 3/20 0.33

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
SCHEMBL27730244 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27396815 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27531714 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27919855 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27801806 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL23733430 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27321157 0.98 HRH3 (0.37) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27953379 0.98 HRH3 (0.36) HRH3L3MBTL1MAPTMAPK1NPSR1
Iodide SCHEMBL15008385 0.96 HRH3 (0.35) HRH3L3MBTL1MAPTMAPK1NPSR1
SCHEMBL27919858 0.96 FDPS (0.36) HRH3L3MBTL1MAPTMAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117043136-A Fluorine-based ionic liquid and method for producing same 第一工业制药株式会社 2023-11-10 CN disclosed
US-20230312498-A1 NON-ATP/CATALYTIC SITE p38 MITOGEN ACTIVATED PROTEIN KINASE INHIBITORS UNIVERSITY OF MARYLAND, BALTIMORE 2023-10-05 US disclosed
US-11718595-B2 Non-ATP/catalytic site p38 Mitogen Activated Protein Kinase inhibitors UNIVERSITY OF MARYLAND, BALTIMORE (US) 2023-08-08 US disclosed
US-20210317097-A1 NON-ATP/CATALYTIC SITE p38 MITOGEN ACTIVATED PROTEIN KINASE INHIBITORS UNIVERSITY OF MARYLAND, BALTIMORE 2021-10-14 US disclosed
US-20210238167-A1 SMALL MOLECULE IRE1-ALPHA INHIBITORS CORNELL UNIVERSITY 2021-08-05 US disclosed
CN-109628004-A Film, surface protective film and optical component with finishing coat 日东电工株式会社 2019-04-16 CN disclosed
CN-103827246-B Adhesive composition, adhesive layer, adhesive sheet, surface protection sheet, optical surface protection sheet, and optical film with surface protection sheet 日东电工株式会社 2018-06-01 CN disclosed
US-20100178333-A1 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER ASTRON RESEARCH LIMITED (IN) 2010-07-15 US disclosed
EP-1976487-A2 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER Astron Research Limited (IN) 2008-10-08 EP disclosed
WO-2007086079-A2 SUSTAINED RELEASE DOSAGE FORM OF PHENOTHIAZINE DERIVATIVES CONTAINING CHANNELIZER ASTRON RESEARCH LIMITED (IN) 2007-08-02 WO disclosed
CN-1840600-A Adhesive composition, adhesive sheets and surface protective film NITTO DENKO CORP (JP) 2006-10-04 CN 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 (4 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-20210317097-A1 NON-ATP/CATALYTIC SITE p38 MITOGEN ACTIVATED PROTEIN KINASE INHIBITORS MAPK1, MAPK8, MAPK4 HRH3 3554/4885L3MBTL1 2364/4885MAPT 2165/4885
US-20230312498-A1 NON-ATP/CATALYTIC SITE p38 MITOGEN ACTIVATED PROTEIN KINASE INHIBITORS MAPK1, MAPK8, MAPK4 HRH3 3554/4885L3MBTL1 2364/4885MAPT 2165/4885
US-20210238167-A1 SMALL MOLECULE IRE1-ALPHA INHIBITORS XBP1, ERN1, ERN2 HRH3 4469/4885L3MBTL1 797/4885MAPT 1670/4885
US-11718595-B2 Non-ATP/catalytic site p38 Mitogen Activated Protein Kinase inhibitors MAPK1, MAPK8, MAPK4 HRH3 3554/4885L3MBTL1 2364/4885MAPT 2165/4885

“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.