SCHEMBL17036337

SCHEMBL17036337

CCCOC(=O)C(C(=O)c1ccccc1)C(C)CC(=O)C1C(C)C=CCC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.30
MAPT P10636 1/20 0.30
PGR P06401 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
HTR2A P28223 1/20 0.30
HRH1 P35367 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL17027579 0.94 LMNA (0.34) LMNAALDH1A1SMN1; SMN2
SCHEMBL17036604 0.92 ALDH1A1 (0.37) LMNAALDH1A1SMN1; SMN2PGRADRA2A
SCHEMBL18815541 0.89 KMT2A (0.36) LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL17027554 0.89 KMT2A (0.34) LMNAALDH1A1SMN1; SMN2
SCHEMBL19996620 0.84
SCHEMBL18815535 0.84 PPARG (0.35) LMNAALDH1A1SMN1; SMN2
SCHEMBL14227660 0.82 HSP90AA1 (0.34) LMNAALDH1A1NPSR1SMN1; SMN2PGR
SCHEMBL18255354 0.82 PGR (0.33) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL18817800 0.80 KDM4E (0.32)
SCHEMBL16863840 0.77

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-9926258-B2 Photolabile pro-fragrances HENKEL AG & CO. KGAA (DE) 2018-03-27 US disclosed
US-20160347704-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2016-12-01 US disclosed
US-20160347704-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2016-12-01 US disclosed
WO-2015124671-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2015-08-27 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-20160347704-A1 PHOTOLABILE PRO-FRAGRANCES CUTA, FAAH, FAAH2 LMNA 387/4885ALDH1A1 94/4885NPSR1 1854/4885

“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.