SCHEMBL24045978

SCHEMBL24045978

O=C(O)CC(O)C(=O)Oc1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 7/20 0.40
HPGD P15428 5/20 0.40
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 8/20 0.38
ESR1 P03372 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
HMGB1 P09429 1/20 0.38
TSHR P16473 1/20 0.38
GGT1 P19440 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
BLM P54132 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38

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
SCHEMBL10391922 0.86 KDM4E (0.54) KDM4EKMT2AMEN1RECQLHSD17B10
SCHEMBL10391924 0.77 KDM4E (0.55) KDM4EKMT2AMEN1RECQLHSD17B10
SCHEMBL11432522 0.76 MAPK1 (0.49) KDM4EKMT2AMEN1RECQLHSD17B10
SCHEMBL27686558 0.75 GAA (0.43) KDM4EKMT2AMEN1HSD17B10HPGD
SCHEMBL28057308 0.75 POLB (0.46) KMT2AMEN1MAPK1ALDH1A1TDP1
SCHEMBL2050907 0.73 KDM4E (0.54) KDM4EKMT2AMEN1RECQLHSD17B10
SCHEMBL1156927 0.73 KDM4E (0.70) KDM4EKMT2AMEN1RECQLHSD17B10
SCHEMBL8995261 0.72 LMNA (0.48) KDM4EKMT2AALDH1A1TDP1FOLH1
SCHEMBL143861 0.71 HTT (0.53) KDM4EKMT2AHSD17B10HPGDMAPK1
SCHEMBL29395127 0.71 HTT (0.53) KDM4EKMT2AHSD17B10HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof ZHEJIANG UNIVERSITY (CN) 2023-10-10 US disclosed
US-20210363297-A1 ORGANIC METAL-FREE CATALYSTS WITH ELECTROPHILIC AND NUCLEOPHILIC DUAL-FUNCTIONS, PREPARATION METHODS OF MAKING THE SAME, AND USES THEREOF ZHEJIANG UNIVERSITY (CN) 2021-11-25 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 (2 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-11780961-B2 Organic metal-free catalysts with electrophilic and nucleophilic dual-functions, preparation methods of making the same, and uses thereof DUOX1, SOD1, DUOX2 KDM4E 3373/4885KMT2A 1593/4885MEN1 2218/4885
US-20210363297-A1 ORGANIC METAL-FREE CATALYSTS WITH ELECTROPHILIC AND NUCLEOPHILIC DUAL-FUNCTIONS, PREPARATION METHODS OF MAKING THE SAME, AND USES THEREOF DUOX1, SOD1, DUOX2 KDM4E 3373/4885KMT2A 1593/4885MEN1 2218/4885

“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.