SCHEMBL18967955

SCHEMBL18967955

CC(=O)OC(=O)C1CCCC(C(=O)OC(C)=O)CCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
RECQL P46063 1/20 0.34
MIF P14174 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 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
SCHEMBL27446531 1.00 SMN1; SMN2 (0.45) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL17033364 0.95 CES2 (0.44) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL776017 0.95 ALDH1A1 (0.43) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL12517329 0.93 CES2 (0.46) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL776393 0.93 CES2 (0.46) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL5094316 0.92
SCHEMBL24838441 0.91 SMN1; SMN2 (0.39) SMN1; SMN2TDP1HTTKMT2AALDH1A1
Methane SCHEMBL20446703 0.91 CES2 (0.44) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL28492260 0.90 ALDH1A1 (0.47) SMN1; SMN2TDP1HTTKMT2AALDH1A1
SCHEMBL6113076 0.84 SMN1; SMN2 (0.52) SMN1; SMN2TDP1HTTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11319282-B2 Diamine compound and method for producing same LG CHEM, LTD. (KR) 2022-05-03 US disclosed
US-20190292138-A1 DIAMINE COMPOUND AND METHOD FOR PRODUCING SAME LG CHEM, LTD. (KR) 2019-09-26 US disclosed
US-10414869-B2 Laminite, and element comprising substrate manufactured using same LG CHEM, LTD. (KR) 2019-09-17 US disclosed
EP-1720065-B1 Photosensitive lithographic printing plate FUJIFILM CORP (JP) 2017-06-14 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-20190292138-A1 DIAMINE COMPOUND AND METHOD FOR PRODUCING SAME DDC, CAD, AOC1 SMN1; SMN2 2296/4885TDP1 1222/4885HTT 795/4885
US-11319282-B2 Diamine compound and method for producing same DDC, CAD, AOC1 SMN1; SMN2 2296/4885TDP1 1222/4885HTT 795/4885

“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.