SCHEMBL7016441

SCHEMBL7016441

CN1ON(CCCSc2ccc3cc(Cl)ccc3c2)C2(CCN(C(=O)OC(C)(C)C)CC2)O1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 2/20 0.35
ANO1 Q5XXA6 1/20 0.35
GPR119 Q8TDV5 5/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
STS P08842 1/20 0.35
CCR5 P51681 1/20 0.34
ALDH1A1 P00352 1/20 0.34
VEGFA P15692 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL7018398 0.83 F10 (0.43) GPR119STS
SCHEMBL7016821 0.81 F10 (0.43) GPR119STS
SCHEMBL7010527 0.69 STS (0.49) KMT2AMEN1SMN1; SMN2MAPTGPR119
SCHEMBL7018071 0.69 F10 (0.44)
SCHEMBL7013701 0.69 F10 (0.44)
SCHEMBL7015918 0.67 IDO1 (0.54) KMT2AMEN1SMN1; SMN2KDM4ETDP1
SCHEMBL7017132 0.67 F10 (0.45)
SCHEMBL7016258 0.67 MEN1 (0.45) KMT2AMEN1SMN1; SMN2GPR119STS
SCHEMBL7019304 0.67 IDO1 (0.53) KMT2AMEN1SMN1; SMN2KDM4ETDP1
SCHEMBL7016584 0.67 FDPS (0.41) KDM4ETDP1

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-20030187023-A1 Sulfone derivatives, process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US disclosed
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP 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-20030187023-A1 Sulfone derivatives, process for their production and use thereof SULT1E1, RRS1, SHH KMT2A 636/4885MEN1 1401/4885SMN1; SMN2 3830/4885

“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.