SCHEMBL22014371

SCHEMBL22014371

COc1cc(C(=O)OCc2ccccc2)cc(OC)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
SLC6A2 P23975 1/20 0.60
SLC6A3 Q01959 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
LMNA P02545 2/20 0.59
ALOX5 P09917 3/20 0.55
PKM P14618 2/20 0.55
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 2/20 0.55
GAA P10253 2/20 0.55
HTT P42858 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA3 P07451 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53

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
SCHEMBL13701209 0.88 HTT (0.67) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL29245495 0.87 PKM (0.60) KMT2ALMNAALOX5PKMALDH1A1
SCHEMBL22015349 0.86 TDP1 (0.62) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL27957224 0.86 MMP1 (0.56) KMT2AALOX5PKMALDH1A1KDM4E
SCHEMBL8886989 0.85 HSD17B2 (0.67) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL17769825 0.85 MAPT (0.61) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL24983859 0.83 HPGD (0.57) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL30141079 0.83 HPGD (0.57) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL7720496 0.82 LMNA (0.60) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL6282770 0.82 KMT2A (0.81) KMT2ASLC6A2SLC6A3TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220009892-A1 SUBSTITUTED PYRIDINE CARBOXYLIC ACIDS, THEIR PREPARATION METHOD AND COMPOSITIONS THEREOF INCILIA THERAPEUTICS PRIVATE LIMITED (IN) 2022-01-13 US disclosed
WO-2020100169-A1 SUBSTITUTED PYRIDINE CARBOXYLIC ACIDS, THEIR PREPARATION METHOD AND COMPOSITIONS THEREOF INCILIA THERAPEUTICS PRIVATE LIMITED (IN) 2020-05-22 WO disclosed
CN-103751162-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating acute inflammation NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN disclosed
CN-103751162-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating acute inflammation NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN disclosed
CN-103751162-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating acute inflammation NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN disclosed
CN-103751167-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating or preventing rheumatoid arthritis NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN disclosed
CN-103751167-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating or preventing rheumatoid arthritis NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN disclosed
CN-103751167-A Application of benzyl-4-hydroxy-3,5-dimethoxy benzoate in preparation of drugs for treating or preventing rheumatoid arthritis NANTONG REPAIR AIR CHEM BIOENG 2014-04-30 CN 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-20220009892-A1 SUBSTITUTED PYRIDINE CARBOXYLIC ACIDS, THEIR PREPARATION METHOD AND COMPOSITIONS THEREOF PC, PCCA, GLS2 KMT2A 2224/4885SLC6A2 1851/4885SLC6A3 1802/4885

“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.