SCHEMBL14707337

SCHEMBL14707337

CC(C)(C)CC(=O)OCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPK1 P28482 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
MAPT P10636 1/20 0.47
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALOX15 P16050 1/20 0.46
CRHBP P24387 1/20 0.46
HTT P42858 1/20 0.46
CRHR2 Q13324 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
IDO1 P14902 2/20 0.46
TACR1 P25103 1/20 0.42
LMNA P02545 1/20 0.42
PTPRC P08575 1/20 0.42

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
SCHEMBL27846776 0.82 MAPK1 (0.57) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL13811595 0.81 MEN1 (0.51) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL11523079 0.79 MEN1 (0.57) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL14712316 0.79 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL13034149 0.78 MEN1 (0.58) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL8832072 0.77 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL16017753 0.77 ESR1 (0.52) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL3928139 0.76 MEN1 (0.56) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL11629539 0.76 MEN1 (0.56) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL11526212 0.75 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130045952-A1 ABA Receptor Agonists for Increased Plant Stress Resistance VAN ANDEL RESEARCH INSTITUTE (US) 2013-02-21 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-20130045952-A1 ABA Receptor Agonists for Increased Plant Stress Resistance BROX, AAK1, ADORA3 ALDH1A1 3422/4885MEN1 4858/4885KMT2A 2708/4885

“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.