SCHEMBL12435910

SCHEMBL12435910

CCC(=O)Nc1cc(C(=O)Oc2cc(OC)c(OC)c(OC)c2)ccc1CO

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 5/20 0.43
MAPK1 P28482 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
AHR P35869 1/20 0.43
LMNA P02545 2/20 0.42
ALDH1A1 P00352 4/20 0.41
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.39
MDH1 P40925 1/20 0.39
MDH2 P40926 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL12435939 0.90 KMT2A (0.43) KMT2AMEN1HTTMAPTMAPK1
SCHEMBL12435936 0.90 KMT2A (0.43) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL12435918 0.90 KMT2A (0.43) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL12435966 0.89 MAPT (0.50) KMT2AMEN1HTTMAPTMAPK1
SCHEMBL12435914 0.89 KMT2A (0.46) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL2215369 0.89 MAPT (0.49) KMT2AMEN1HTTMAPTMAPK1
SCHEMBL17507539 0.86 ALDH1A1 (0.49) KMT2AMEN1HTTMAPTMAPK1
SCHEMBL12436026 0.85 MEN1 (0.43) KMT2AMEN1MAPTMAPK1LMNA
SCHEMBL12435940 0.84 KMT2A (0.42) KMT2AMEN1MAPTMAPK1SMN1; SMN2
SCHEMBL12435928 0.84 KMT2A (0.42) KMT2AMEN1MAPTMAPK1SMN1; SMN2

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-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use Institute of Medicinal Biotechnology Academy of Medical Science (CN) 2011-07-21 US disclosed
US-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use Institute of Medicinal Biotechnology Academy of Medical Science (CN) 2011-07-21 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-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use CUL3, APOBEC3G, BRPF3 KMT2A 964/4885MEN1 4747/4885HTT 1248/4885

“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.