SCHEMBL3224261

SCHEMBL3224261

O=S(=O)(c1ccccc1C(F)(F)F)N1CCC(c2ccccc2C(F)(F)F)CC1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.70
MEN1 O00255 2/20 0.70
RBP4 P02753 4/20 0.56
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.51
HTR2C P28335 2/20 0.50
CNR1 P21554 1/20 0.48
CHRM4 P08173 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
SCHEMBL3210401 0.91 KMT2A (0.57) KMT2AMEN1RBP4L3MBTL1ALDH1A1
SCHEMBL8260988 0.83 KMT2A (0.74) KMT2AMEN1L3MBTL1ALDH1A1POLB
SCHEMBL3225849 0.83 RBP4 (0.52) KMT2AMEN1RBP4HTR2CCNR1
SCHEMBL3205508 0.83 KMT2A (0.54) KMT2AMEN1RBP4L3MBTL1ALDH1A1
SCHEMBL3221289 0.82 HSD11B1 (0.64) KMT2AMEN1RBP4POLB
SCHEMBL14686256 0.82 KMT2A (0.68) KMT2AMEN1L3MBTL1ALDH1A1POLB
SCHEMBL3209386 0.82 HSD11B1 (0.55) KMT2AMEN1RBP4ALDH1A1POLB
SCHEMBL3215762 0.82 GPR183 (0.53) KMT2AMEN1RBP4ALDH1A1HTR2C
SCHEMBL31684031 0.81 KMT2A (0.87) KMT2AMEN1L3MBTL1ALDH1A1CHRM4
SCHEMBL3201836 0.80 LMNA (0.60) KMT2AMEN1RBP4ALDH1A1

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-20100029648-A1 11-Beta HSD1 Inhibitors XIANG JASON SHAOYUN 2010-02-04 US disclosed
US-7632838-B2 11-beta HSD1 inhibitors WYETH (US) 2009-12-15 US disclosed
US-20070219198-A1 11-Beta HSD 1 inhibitors WYETH (US) 2007-09-20 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-20100029648-A1 11-Beta HSD1 Inhibitors HSD11B1, HSD3B1, HSD11B2 KMT2A 1609/4885MEN1 1354/4885RBP4 2175/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 KMT2A 1591/4885MEN1 1687/4885RBP4 2329/4885

“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.