SCHEMBL4202305

SCHEMBL4202305

CC(O)NCCCCCCNC(C)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
HIF1A Q16665 2/20 0.37
HRH3 Q9Y5N1 2/20 0.37
TSHR P16473 2/20 0.37
MEN1 O00255 1/20 0.37
XBP1 P17861 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ABCB11 O95342 1/20 0.37
EGFR P00533 1/20 0.37
ESR1 P03372 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
FYN P06241 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL4209411 1.00 SIGMAR1 (0.37) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL4202303 0.97 ALDH1A1 (0.34) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL4211600 0.90 TSHR (0.32) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL16390301 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL10570528 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL25021707 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL380547 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL22802922 0.89 EPHX1 (0.46) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL965946 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A
SCHEMBL16389925 0.89 ALDH1A1 (0.47) SIGMAR1LMNAALDH1A1MAPK1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10023530-B2 Diamine, polyamic acid, and polyimide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-07-17 US disclosed
EP-1828354-B1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF SE (DE) 2017-09-06 EP disclosed
US-20160264520-A1 NOVEL DIAMINE, POLYAMIC ACID, AND POLYIMIDE NISSAN CHEMICAL INDUSTRIES. LTD. (JP) 2016-09-15 US disclosed
US-20160208088-A1 Racemic Drug Resolution Using Polymer Supported Chiral Selector COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-07-21 US disclosed
US-20100075061-A1 INK COMPOSITION, INKJET RECORDING METHOD AND METHOD FOR PRODUCING PRINTED FORMED ARTICLE FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-20090235576-A1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF AKTIENGESELLSCHAFT (DE) 2009-09-24 US disclosed
EP-1828354-A1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF AKTIENGESELLSCHAFT (DE) 2007-09-05 EP disclosed
WO-2007039488-A1 HYDROXYALKYL-SUBSTITUTED AMINOALKYLAMIDES OF FATTY ACIDS AS FRICTION MODIFYING AGENTS BASF SE (DE) 2007-04-12 WO disclosed
WO-2006063770-A1 HYDROCARBYL SUCCINIC ACID AND HYDROCARBYLSUCCINIC ACID DERIVATIVES AS FRICTION MODIFIERS BASF AKTIENGESELLSCHAFT (DE) 2006-06-22 WO disclosed
EP-1669433-A1 Hydrocarbyl succinic acid and hydrocarbylsuccinic acid derivatives as friction modifiers BASF AKTIENGESELLSCHAFT (DE) 2006-06-14 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-10023530-B2 Diamine, polyamic acid, and polyimide H1-2, H1-4, H1-0 SIGMAR1 744/4885LMNA 746/4885ALDH1A1 1921/4885
US-20160264520-A1 NOVEL DIAMINE, POLYAMIC ACID, AND POLYIMIDE H1-4, H1-2, H1-5 SIGMAR1 809/4885LMNA 1011/4885ALDH1A1 1919/4885

“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.