SCHEMBL4002852

SCHEMBL4002852

COC1CCC(C(=O)N[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)CC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.60
TSHR P16473 1/20 0.59
KMT2A Q03164 3/20 0.54
CYP2C19 P33261 1/20 0.54
MEN1 O00255 2/20 0.54
HSD17B10 Q99714 1/20 0.54
ALDH1A1 P00352 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
USP2 O75604 1/20 0.52
MAPK1 P28482 1/20 0.52
LMNA P02545 2/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL4002862 1.00 EPHX2 (0.60) EPHX2TSHRKMT2ACYP2C19MEN1
SCHEMBL4010698 0.87 EPHX2 (0.65) EPHX2TSHRKMT2AMEN1ALDH1A1
SCHEMBL4010700 0.87 EPHX2 (0.65) EPHX2TSHRKMT2AMEN1ALDH1A1
SCHEMBL4005679 0.87 EPHX2 (0.76) EPHX2TSHRKMT2AMEN1ALDH1A1
SCHEMBL4010762 0.82 HSD11B1 (0.72) EPHX2TSHRRAB9A
SCHEMBL4003059 0.82 HSD11B1 (0.72) EPHX2TSHRRAB9A
SCHEMBL4003066 0.82 HSD11B1 (0.72) EPHX2TSHRRAB9A
SCHEMBL612912 0.82 KMT2A (0.78) EPHX2TSHRKMT2AMEN1ALDH1A1
SCHEMBL611344 0.82 KMT2A (0.78) EPHX2TSHRKMT2AMEN1ALDH1A1
SCHEMBL609708 0.81 EPHX2 (0.77) EPHX2TSHRKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP claimed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP claimed
US-20060122197-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-08 US claimed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO claimed
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
US-20060122197-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-08 US disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO 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-20060122197-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 EPHX2 788/4885TSHR 328/4885KMT2A 3418/4885

“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.