SCHEMBL840925

SCHEMBL840925

CC(C)(C)OCc1ccccc1-c1c2ccc(=O)cc-2oc2c(Cl)c(O)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
POLB P06746 4/20 0.40
USP2 O75604 3/20 0.40
ATM Q13315 1/20 0.40
PLEC Q15149 1/20 0.40
ESR1 P03372 4/20 0.36
ESR2 Q92731 4/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
HPGD P15428 4/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
RECQL P46063 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL840931 0.83 KDM4A (0.44) USP2ESR1ESR2ALDH1A1HPGD
SCHEMBL841016 0.83 MEN1 (0.60) MEN1KMT2APOLBUSP2ATM
SCHEMBL21974398 0.74 MEN1 (0.38) MEN1KMT2APOLBUSP2ATM
SCHEMBL12708320 0.69 MEN1 (0.68) MEN1KMT2APOLBUSP2ATM
SCHEMBL23941076 0.68 HSD17B10 (0.49) MEN1KMT2APOLBUSP2ATM
SCHEMBL23941083 0.68 USP2 (0.41) MEN1KMT2APOLBUSP2ATM
SCHEMBL840985 0.68 USP2 (0.59) MEN1KMT2APOLBUSP2ATM
SCHEMBL15305308 0.67 MEN1 (0.61) MEN1KMT2APOLBUSP2ATM
SCHEMBL14433567 0.67 MEN1 (0.68) MEN1KMT2APOLBUSP2ATM
SCHEMBL23941086 0.67 ALDH1A1 (0.41) MEN1KMT2APOLBUSP2ATM

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-8143069-B2 useful for selective measurement of hypochlorite ion; does not react with hydrogen peroxide which is a weakly reactive oxygen species, and does not induce increase of fluorescence with hydroxyl radical or peroxynitrite which are reactive oxygen species having high activity THE UNIVERSITY OF TOKYO (JP) 2012-03-27 US disclosed
US-20090317914-A1 FLUORESCENT PROBE THE UNIVERSITY OF TOKYO (JP) 2009-12-24 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-20090317914-A1 FLUORESCENT PROBE H1-10, H1-0, NHERF1 MEN1 444/4885KMT2A 2962/4885POLB 1720/4885

“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.