SCHEMBL3398540

SCHEMBL3398540

Cc1ccc(COC(=O)CCC(=O)CN)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
ALDH1A1 P00352 3/20 0.50
GAA P10253 2/20 0.50
LMNA P02545 3/20 0.49
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HTR2C P28335 1/20 0.44
MMP2 P08253 2/20 0.43
MMP12 P39900 2/20 0.43
AGXT P21549 2/20 0.43
PARP10 Q53GL7 1/20 0.42
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41

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
Hydrochloric Acid SCHEMBL1177366 0.98 MAPT (0.52) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL1177288 0.93 ALDH1A1 (0.51) MAPTALDH1A1GAALMNAKMT2A
Chloroacetic Acid SCHEMBL19183007 0.92 ALDH1A1 (0.47) MAPTALDH1A1GAALMNAKMT2A
Trichloroacetic Acid SCHEMBL19183346 0.90 ALDH1A1 (0.46) MAPTALDH1A1GAALMNAKMT2A
Dichloroacetic Acid SCHEMBL19183184 0.90 ALDH1A1 (0.46) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL1177415 0.89 ALDH1A1 (0.54) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL2533623 0.88 MAPT (0.63) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL10676527 0.84 AGXT (0.50) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL27790577 0.84 ALDH1A1 (0.51) MAPTALDH1A1GAALMNAKMT2A
SCHEMBL1177416 0.84 LMNA (0.48) MAPTALDH1A1GAALMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101896203-A Use of solid forms of 5-aminolevulinic acid and derivatives in photodynamic therapy and diagnosis PHOTOCURE ASA 2010-11-24 CN claimed
CN-104524576-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2015-04-22 CN disclosed
CN-104306968-A Use of 5-aminolevulinic acid and derivatives in a solid form for photodynamic treatment and diagnosis PHOTOCURE ASA 2015-01-28 CN disclosed
CN-104069493-A Use of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2014-10-01 CN disclosed
US-8546447-B2 Treatment of acne using derivatives of 5-aminolevulinic acid PHOTOCURE ASA (NO) 2013-10-01 US disclosed
US-20130066256-A1 Treatment of Acne Using Derivatives of 5-Aminolevulinic Acid PHOTOCURE ASA (NO) 2013-03-14 US disclosed
CN-101896203-A Use of solid forms of 5-aminolevulinic acid and derivatives in photodynamic therapy and diagnosis PHOTOCURE ASA 2010-11-24 CN disclosed
EP-1814534-B1 DERIVATIVES OF 5-AMINOLEVULINIC ACID FOR THE TREATMENT OF ACNE PHOTOCURE ASA (NO) 2010-06-02 EP disclosed
CN-101631541-A Application of aminolevulinic acid and derivatives thereof PHOTOCURE ASA 2010-01-20 CN disclosed
US-20080188558-A1 Treatment of Acne Using Derivatives of 5-Aminolevulinic Acid PHOTOCURE ASA (NO) 2008-08-07 US disclosed
EP-1814534-A1 TREATMENT OF ACNE USING DERIVATIVES OF 5-AMINOLEVULINIC ACID Photocure ASA (NO) 2007-08-08 EP disclosed
WO-2006051269-A1 TREATMENT OF ACNE USING DERIVATIVES OF 5-AMINOLEVULINIC ACID PHOTOCURE ASA (NO) 2006-05-18 WO disclosed