SCHEMBL1401944

SCHEMBL1401944

CCCCOC(=O)C(=O)O.[SnH2]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
ATM Q13315 1/20 0.52
TSHR P16473 5/20 0.50
HCAR2 Q8TDS4 3/20 0.50
HPGD P15428 1/20 0.48
NAAA Q02083 1/20 0.45
ESR1 P03372 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EPHX1 P07099 1/20 0.42
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
NR1H2 P55055 1/20 0.41
RNASEL Q05823 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1401947 0.98 ALDH1A1 (0.58) ALDH1A1ATMTSHRHCAR2HPGD
SCHEMBL1948952 0.98 ALDH1A1 (0.58) ALDH1A1ATMTSHRHCAR2HPGD
Hydrochloric Acid SCHEMBL10892981 0.95 ALDH1A1 (0.56) ALDH1A1ATMTSHRHCAR2HPGD
Ammonia Solution, Strong SCHEMBL27659655 0.95 ALDH1A1 (0.56) ALDH1A1ATMTSHRHCAR2HPGD
Water SCHEMBL27921488 0.95 ALDH1A1 (0.56) ALDH1A1ATMTSHRHCAR2HPGD
Hydrazine SCHEMBL1234309 0.93 ALDH1A1 (0.54) ALDH1A1ATMTSHRHCAR2HPGD
Acetic Acid SCHEMBL28461574 0.93 ALDH1A1 (0.60) ALDH1A1ATMTSHRHCAR2HPGD
SCHEMBL368375 0.91 TSHR (0.61) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL2456609 0.88 TSHR (0.64) ALDH1A1TSHRHCAR2NAAARAD52
SCHEMBL3021576 0.88 TSHR (0.64) ALDH1A1TSHRHCAR2NAAARAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027894-A Adhesive, negative electrode slurry and lithium ion battery 深圳好电科技有限公司 2024-05-14 CN disclosed
CN-116574213-A Polymer microsphere, functional microsphere with isocyanate group and polymer supported catalyst 北京化工大学 2023-08-11 CN disclosed
US-8895773-B2 Manufacture and use of alkyl p-toluates INVISTA NORTH AMERICA S.A.R.L. (US) 2014-11-25 US disclosed
EP-2291347-A2 MANUFACTURE AND USE OF ALKYL P-TOLUATES Invista Technologies S.à.r.l. (CH) 2011-03-09 EP disclosed
US-20090286912-A1 MANUFACTURE AND USE OF ALKYL p-TOLUATES INVISTA NORTH AMERICA S.A R.L. (US) 2009-11-19 US disclosed
WO-2009137775-A2 MANUFACTURE AND USE OF ALKYL P-TOLUATES INVISTA TECHNOLOGIES S.A R.L. (CH) 2009-11-12 WO 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-20090286912-A1 MANUFACTURE AND USE OF ALKYL p-TOLUATES EP300, TERT, NAPEPLD ALDH1A1 186/4885ATM 622/4885TSHR 3767/4885

“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.