SCHEMBL22987232

SCHEMBL22987232

O=C(O)CCc1ccc(C(=O)NCc2ccccc2Br)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.67
KMT2A Q03164 1/20 0.60
PPARG P37231 1/20 0.59
FFAR1 O14842 4/20 0.56
NR1H4 Q96RI1 1/20 0.56
FFAR4 Q5NUL3 1/20 0.56
HDAC6 Q9UBN7 3/20 0.51
HDAC1 Q13547 3/20 0.51
HDAC2 Q92769 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
TTR P02766 1/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC10 Q969S8 1/20 0.48

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
SCHEMBL2905172 0.84 KMT2A (0.77) EPHX2KMT2AHDAC6HDAC1HDAC2
SCHEMBL28654120 0.84 SMN1; SMN2 (0.68) EPHX2KMT2APPARGFFAR1NR1H4
SCHEMBL22987225 0.83 PPARG (0.81) EPHX2PPARGFFAR1NR1H4FFAR4
SCHEMBL28665658 0.82 KMT2A (0.65) EPHX2KMT2ANR1H4HDAC6HDAC1
SCHEMBL28656782 0.79 EPHX2 (0.78) EPHX2PPARGPPARDPPARA
SCHEMBL5642848 0.79 KMT2A (0.68) EPHX2KMT2AHDAC1TTRALDH1A1
SCHEMBL22987233 0.78 EPHX2 (0.69) EPHX2PPARGFFAR1NR1H4FFAR4
SCHEMBL28926992 0.78 EPHX2 (0.62) EPHX2KMT2APPARGALDH1A1
SCHEMBL28648931 0.76 KMT2A (0.65) EPHX2KMT2ANR1H4HDAC6HDAC1
SCHEMBL22987223 0.76 HPGD (0.74) EPHX2PPARGFFAR1NR1H4FFAR4

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-20210238125-A1 Diabetes and Metabolic Syndrome Treatment with a Novel Dual Modulator of Soluble Epoxide Hydrolase and Peroxisome Proliferator-Activated Receptors THE MEDICAL COLLEGE OF WISCONSIN, INC. (US) 2021-08-05 US disclosed
US-10927069-B2 Diabetes and metabolic syndrome treatment with a novel dual modulator of soluble epoxide hydrolase and peroxisome proliferator-activated receptors THE MEDICAL COLLEGE OF WISCONSIN, INC. (US) 2021-02-23 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-10927069-B2 Diabetes and metabolic syndrome treatment with a novel dual modulator of soluble epoxide hydrolase and peroxisome proliferator-activated receptors EPHX1, EPHX2, PPARG EPHX2 2/4885KMT2A 2564/4885PPARG 3/4885
US-20210238125-A1 Diabetes and Metabolic Syndrome Treatment with a Novel Dual Modulator of Soluble Epoxide Hydrolase and Peroxisome Proliferator-Activated Receptors EPHX1, EPHX2, PPARG EPHX2 2/4885KMT2A 2610/4885PPARG 3/4885

“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.