SCHEMBL16616993

SCHEMBL16616993

CCOC(=O)CC(CC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
NPC1 O15118 1/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
ATM Q13315 1/20 0.60
F2 P00734 4/20 0.55
F10 P00742 4/20 0.52
ALDH1A1 P00352 2/20 0.51
POLB P06746 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HTT P42858 1/20 0.50
TSHR P16473 2/20 0.47
PRSS1 P07477 1/20 0.46
PTPN1 P18031 1/20 0.45

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
SCHEMBL16624911 0.93 F2 (0.55) KMT2AMEN1NPC1L3MBTL1ATM
SCHEMBL232194 0.91 F2 (0.59) KMT2AMEN1NPC1F2F10
SCHEMBL16624892 0.89 L3MBTL1 (0.71) KMT2AMEN1NPC1L3MBTL1ATM
SCHEMBL7141857 0.86 F2 (0.55) KMT2AMEN1NPC1F2F10
SCHEMBL28642234 0.86 F2 (0.55) KMT2AMEN1NPC1F2F10
SCHEMBL16624902 0.85 L3MBTL1 (0.53) KMT2AMEN1NPC1L3MBTL1ATM
SCHEMBL16617094 0.84 L3MBTL1 (0.68) KMT2AMEN1NPC1L3MBTL1ATM
SCHEMBL4405154 0.84 F2 (0.56) KMT2AMEN1NPC1F2F10
SCHEMBL30040482 0.84 F2 (0.56) KMT2AMEN1NPC1F2F10
SCHEMBL9066674 0.83 ATM (0.74) KMT2AMEN1NPC1L3MBTL1ATM

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 7 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-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
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 KMT2A 2118/4885MEN1 556/4885NPC1 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.