SCHEMBL7018240

SCHEMBL7018240

CCOC(=O)NC1(C(=O)N(C)C(CCc2ccc3cc(Cl)ccc3c2)=S(=O)=O)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 4/20 0.34
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
ANO1 Q5XXA6 1/20 0.34
HTT P42858 1/20 0.34
ALOX15 P16050 1/20 0.33
GPR4 P46093 3/20 0.33
MAPT P10636 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
CCR5 P51681 1/20 0.32

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
SCHEMBL7018243 0.81 ANO1 (0.35) TP53POLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL7018233 0.75 F10 (0.44)
SCHEMBL7018924 0.68 F10 (0.46)
SCHEMBL5741924 0.67 MAPT (0.42) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL7009183 0.67 EPHX2 (0.40) ALDH1A1KMT2ASMN1; SMN2MEN1ALOX15
SCHEMBL6507749 0.66 MEN1 (0.44) KMT2AMEN1ALOX15
SCHEMBL5741819 0.66 MAPT (0.44) POLBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL7018207 0.66 F10 (0.44) TP53POLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL1001879 0.65 SMN1; SMN2 (0.57) ALDH1A1KMT2ASMN1; SMN2NPSR1MEN1
SCHEMBL3489412 0.65 MEN1 (0.39) KMT2AMEN1ANO1

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 TP53 4391/4885POLB 3954/4885ALDH1A1 4317/4885

“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.