SCHEMBL7017438

SCHEMBL7017438

CC(CS(=O)(=O)c1ccc2cc(Cl)ccc2c1)C(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 2/20 0.53
DRD4 P21917 3/20 0.52
SLC6A12 P48065 2/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MCHR1 Q99705 2/20 0.52
ACHE P22303 1/20 0.51
SIGMAR1 Q99720 5/20 0.51
SLC6A13 Q9NSD5 1/20 0.50
HTT P42858 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
SCHEMBL7016180 0.78 F10 (0.61)
Benzene SCHEMBL10799860 0.75 SIGMAR1 (0.62) DRD4ALDH1A1KMT2ASMN1; SMN2SIGMAR1
SCHEMBL3306841 0.74 SIGMAR1 (0.68) DRD4ALDH1A1KMT2ASMN1; SMN2SIGMAR1
SCHEMBL29712058 0.72 SIGMAR1 (0.65) DRD4ALDH1A1KMT2ASMN1; SMN2SIGMAR1
SCHEMBL4848461 0.72 SIGMAR1 (0.65) DRD4ALDH1A1KMT2ASMN1; SMN2SIGMAR1
SCHEMBL12226832 0.72 SIGMAR1 (0.61) DRD4ALDH1A1KMT2ASIGMAR1
SCHEMBL6787343 0.69 KMT2A (0.98) CCR4DRD4SLC6A12ALDH1A1KMT2A
SCHEMBL7012011 0.69 F10 (0.52)
SCHEMBL29778710 0.69 SIGMAR1 (0.58) DRD4SIGMAR1
SCHEMBL17301746 0.69 SIGMAR1 (0.60) DRD4ALDH1A1KMT2AMCHR1SIGMAR1

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 CCR4 2242/4885DRD4 433/4885SLC6A12 1111/4885

“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.