SCHEMBL4662149

SCHEMBL4662149

CC(C(=O)O)c1cnc(C(C)C(=O)O)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.39
LMNA P02545 4/20 0.37
PTGS1 P23219 6/20 0.36
CXCR1 P25024 4/20 0.36
CXCR2 P25025 4/20 0.36
AKR1C3 P42330 3/20 0.36
CYP2C9 P11712 2/20 0.36
SLC22A6 Q4U2R8 2/20 0.36
CXCL8 P10145 2/20 0.36
AKR1C2 P52895 2/20 0.36
PMP22 Q01453 2/20 0.36
ALB P02768 1/20 0.36
ESR1 P03372 1/20 0.36
ALOX5 P09917 1/20 0.36
RARB P10826 1/20 0.36
ADRB3 P13945 1/20 0.36
NFKB1 P19838 1/20 0.36
HTR2A P28223 1/20 0.36
NR1I3 Q14994 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL17765333 0.83 LMNA (0.36) LMNAAKR1C3AKR1C2
SCHEMBL11679493 0.82 PTGS2 (0.47) PTGS2LMNAPTGS1AKR1C3CYP2C9
SCHEMBL6037597 0.81 LMNA (0.51) LMNAAKR1C3AKR1C2TSHRSMN1; SMN2
SCHEMBL11678400 0.79 KMO (0.39) PTGS2PTGS1SMN1; SMN2KDM4EHIF1A
SCHEMBL10484478 0.79 LMNA (0.50) LMNAAKR1C3AKR1C2TSHRSMN1; SMN2
SCHEMBL31240136 0.79 MAPT (0.43) PTGS2AKR1C3AKR1C2SMN1; SMN2MAPT
SCHEMBL11678265 0.78 ACACB (0.41) PTGS2LMNATP53SMN1; SMN2MAPT
SCHEMBL11684120 0.78 KMO (0.41) SMN1; SMN2KDM4EHIF1A
SCHEMBL31425044 0.78 KDM4E (0.48) PTGS2TSHRTP53SMN1; SMN2RXFP1
SCHEMBL18982637 0.78 KDM4E (0.48) PTGS2TSHRTP53SMN1; SMN2RXFP1

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-117630189-A Method for detecting hexyl aminolevulinate hydrochloride 广东精观生物医药科技有限公司 2024-03-01 CN disclosed
CN-101472879-B Novel crystal of 5-aminolevulinic acid phosphate and process for production thereof COSMO OIL CO LTD 2013-11-13 CN disclosed
CN-101472879-A Novel crystal of 5-aminolevulinic acid phosphate and process for production thereof COSMO OIL CO LTD (JP) 2009-07-01 CN disclosed
EP-2007711-A1 5-AMINOLEVULINIC ACID SALTS AND THEIR USE Bar Ilan University (IL) 2008-12-31 EP disclosed
US-20070225518-A1 5-Aminolevulinic acid salts and their use SYNERON MEDICAL LTD. (IL) 2007-09-27 US disclosed
WO-2007107998-A1 5-AMINOLEVULINIC ACID SALTS AND THEIR USE BAR ILAN UNIVERSITY (IL) 2007-09-27 WO disclosed
EP-1007504-B1 STERILIZED 5-AMINOLEVULINIC ACID DUSA PHARMACEUTICALS INC (CA) 2004-06-09 EP disclosed
US-6335465-B1 COLORED 5-AMINOLEVULINIC ACID CRYSTALS, WHEREIN SAID COLOR IS IMPARTED BY IRRADIATION OF CRYSTALS DUSA PHARMACEUTICALS, INC. (CA) 2002-01-01 US disclosed
EP-1007504-A1 STERILIZED 5-AMINOLEVULINIC ACID Dusa Pharmaceuticals, Inc. (CA) 2000-06-14 EP disclosed
WO-1999011604-A9 STERILIZED 5-AMINOLEVULINIC ACID DUSA PHARMACEUTICALS INC (CA) 1999-07-08 WO disclosed
WO-1999011604-A1 STERILIZED 5-AMINOLEVULINIC ACID DUSA PHARMACEUTICALS, INC. (CA) 1999-03-11 WO disclosed
US-5856566-A COLORED PARTICLES; IRRADIATION OF CRYSTALS DUSA PHARMACEUTICALS, INC. (CA) 1999-01-05 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-20070225518-A1 5-Aminolevulinic acid salts and their use ALAD, ALOX5, ADSL PTGS2 659/4885LMNA 3784/4885PTGS1 1325/4885

“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.