SCHEMBL3299178

SCHEMBL3299178

COc1ccc(Cl)cc1NC(=O)Nc1ccc(C2CCC(C(=O)OC(C)C)CC2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.47
MEN1 O00255 4/20 0.47
MAPT P10636 2/20 0.45
STAT3 P40763 1/20 0.44
ALDH1A1 P00352 4/20 0.43
GAA P10253 1/20 0.43
KCNT1 Q5JUK3 4/20 0.43
LPAR1 Q92633 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL14113411 1.00 KMT2A (0.47) KMT2AMEN1MAPTSTAT3ALDH1A1
SCHEMBL3299175 1.00 KMT2A (0.47) KMT2AMEN1MAPTSTAT3ALDH1A1
SCHEMBL3302704 0.90 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1GAA
SCHEMBL3302702 0.90 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1GAA
SCHEMBL14113715 0.90 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1GAA
SCHEMBL13389879 0.88 KMT2A (0.52) KMT2AMEN1MAPTSTAT3ALDH1A1
SCHEMBL3301417 0.88 KMT2A (0.51) KMT2AMEN1MAPTSTAT3ALDH1A1
SCHEMBL3301411 0.88 KMT2A (0.51) KMT2AMEN1MAPTSTAT3ALDH1A1
SCHEMBL3307431 0.83 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1GAA
SCHEMBL14113717 0.83 ALDH1A1 (0.55) KMT2AMEN1MAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES PROSIDION LIMITED (GB) 2010-04-15 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-20100093733-A1 AMIDE AND UREA DERIVATIVES FOR THE TREATMENT OF METABOLIC DISEASES CPS1, GOT2, GPR119 KMT2A 1665/4885MEN1 2505/4885MAPT 1308/4885

“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.