SCHEMBL16624890

SCHEMBL16624890

COc1ccc(C(=O)CC(CC(=O)O)c2ccccc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.81
FNTA P49354 1/20 0.61
FNTB P49356 1/20 0.61
ALDH1A1 P00352 4/20 0.55
ATM Q13315 1/20 0.55
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
HTT P42858 2/20 0.52
POLB P06746 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
PDE4B Q07343 1/20 0.51
FFAR1 O14842 1/20 0.51
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
HSD11B1 P28845 1/20 0.50
PTPN1 P18031 1/20 0.50
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL19071295 0.91 L3MBTL1 (0.81) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL16624900 0.89 L3MBTL1 (0.76) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL12158739 0.88 L3MBTL1 (0.76) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL2586619 0.88 L3MBTL1 (0.76) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL657370 0.87 L3MBTL1 (0.60) L3MBTL1FNTAFNTBATMPTPN1
SCHEMBL16624892 0.85 L3MBTL1 (0.71) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL812734 0.85 L3MBTL1 (0.70) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL809823 0.85 L3MBTL1 (0.70) L3MBTL1FNTAFNTBALDH1A1ATM
SCHEMBL2397228 0.84 L3MBTL1 (0.69) L3MBTL1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2226074 0.84 L3MBTL1 (0.68) L3MBTL1FNTAFNTBATMPOLB

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 1799/4885FNTA 1826/4885FNTB 985/4885

“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.