SCHEMBL16624914

SCHEMBL16624914

CCCCCOC(=O)CC(c1ccccc1)C(C)C(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 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
SCHEMBL16624915 0.93 SMN1; SMN2 (0.44) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL16624910 0.91 SMN1; SMN2 (0.46) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL16624893 0.85 MEN1 (0.48) SMN1; SMN2LMNANPC1TSHRCYP3A4
SCHEMBL16624896 0.84 SLC22A1 (0.42) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL19071744 0.79 GAA (0.42) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL16624926 0.79 KCNA5 (0.58) SMN1; SMN2LMNATSHRCYP3A4ALDH1A1
SCHEMBL16624901 0.79 F2 (0.46) LMNANPC1RAB9ATSHRCYP3A4
SCHEMBL5668366 0.78 NPC1 (0.64) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL14680082 0.78 NPC1 (0.56) SMN1; SMN2LMNANPC1RAB9ATSHR
SCHEMBL16624902 0.78 L3MBTL1 (0.53) SMN1; SMN2LMNANPC1RAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2864284-B1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO KGAA (DE) 2017-07-05 EP disclosed
US-9458081-B2 Photolabile pro-fragrances HENKEL AG & CO. KGAA (DE) 2016-10-04 US disclosed
US-9458081-B2 Photolabile pro-fragrances HENKEL AG & CO. KGAA (DE) 2016-10-04 US disclosed
US-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2015-04-09 US disclosed
US-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2015-04-09 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-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES TRPA1, PSAP, CRY1 SMN1; SMN2 2584/4885LMNA 1058/4885NPC1 4348/4885

“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.