SCHEMBL16624902

SCHEMBL16624902

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

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
ATM Q13315 1/20 0.53
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
POLB P06746 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.43
PPARG P37231 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
SCHEMBL16624916 0.93 L3MBTL1 (0.46) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL16624894 0.91 L3MBTL1 (0.63) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL14680082 0.90 NPC1 (0.56) NPC1RAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL9467365 0.87 ALDH1A1 (0.54) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL16616993 0.85 KMT2A (0.60) L3MBTL1ATMNPC1KMT2AMEN1
SCHEMBL29012579 0.84 NPC1 (0.52) NPC1RAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL9468152 0.83 ALDH1A1 (0.50) L3MBTL1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL8072408 0.83 ALDH1A1 (0.49) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL7674007 0.83 ALDH1A1 (0.49) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL16624895 0.83 L3MBTL1 (0.55) L3MBTL1ATMNPC1SMN1; SMN2LMNA

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 L3MBTL1 1799/4885ATM 2943/4885NPC1 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.