SCHEMBL2821150

SCHEMBL2821150

CCOC(=O)CCC(=O)c1ccc(Cl)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
MAPT P10636 5/20 0.45
L3MBTL1 Q9Y468 4/20 0.43
HPGD P15428 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL18179683 0.89 KMT2A (0.46) KMT2AMEN1MAPTL3MBTL1HPGD
SCHEMBL11152588 0.87 TSHR (0.50) KMT2AMEN1MAPTL3MBTL1HPGD
SCHEMBL1374055 0.84 TDP1 (0.51) KMT2AMEN1MAPTL3MBTL1HPGD
SCHEMBL1821139 0.83 MAPT (0.45) KMT2AMEN1MAPTL3MBTL1HPGD
SCHEMBL8187564 0.82 MAPT (0.56) KMT2AMEN1MAPTL3MBTL1HPGD
SCHEMBL6903596 0.80 CA12 (0.56) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL1376927 0.79 SMN1; SMN2 (0.44) KMT2AMEN1MAPTL3MBTL1TDP1
SCHEMBL11412681 0.79 CA1 (0.53) L3MBTL1ALDH1A1RAB9A
SCHEMBL5313540 0.79 USP5 (0.49) KMT2AL3MBTL1HPGDALDH1A1LMNA
SCHEMBL4686898 0.79 LMNA (0.61) KMT2AMEN1MAPTL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256165-A1 LARGE CONDUCTANCE CALCIUM-ACTIVATED K CHANNEL OPENER HONGU MITSUYA 2010-10-07 US disclosed
US-7759373-B2 Large conductance calcium-activated K channel opener MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-07-20 US disclosed
US-20040127527-A1 Large conductance calcium-activated k channel opener MITSUBISHI TANABE PHARMA CORPORATION (JP) 2004-07-01 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-20100256165-A1 LARGE CONDUCTANCE CALCIUM-ACTIVATED K CHANNEL OPENER KCNN3, KCNN2, KCNN1 KMT2A 1947/4885MEN1 2380/4885MAPT 2752/4885
US-20040127527-A1 Large conductance calcium-activated k channel opener KCNN1, KCNN4, KCNN3 KMT2A 2017/4885MEN1 3427/4885MAPT 3090/4885

“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.