SCHEMBL2444102

SCHEMBL2444102

[CH2]N(C)S(=O)(=O)c1cccc2[nH]ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.41
HTR6 P50406 2/20 0.38
CCR10 P46092 1/20 0.37
DHPS P49366 2/20 0.36
HTR1A P08908 1/20 0.36
PIK3CD O00329 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
HIF1A Q16665 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
C1R P00736 1/20 0.35
PRSS1 P07477 1/20 0.35
PIP4K2A P48426 1/20 0.34
PIP4K2B P78356 1/20 0.34
PIP4K2C Q8TBX8 1/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 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
SCHEMBL10179436 0.78 AHR (0.47) AHRHTR6DHPSPIK3CDPIP4K2A
SCHEMBL28621770 0.77 AHR (0.50) AHRHTR6DHPSPIK3CDTDP1
SCHEMBL2443893 0.75 NR3C1 (0.51) AHRHTR6C1RPRSS1HTR2A
SCHEMBL337953 0.74 AHR (0.52) AHRHTR6DHPSPIK3CDMAPK1
SCHEMBL1037724 0.74 AHR (0.47) AHRHTR6DHPSPIK3CDMAPK1
SCHEMBL29751642 0.74 AHR (0.47) AHRHTR6DHPSPIK3CDPIP4K2A
SCHEMBL3799597 0.74 TTR (0.47) AHRHTR6DHPSPIK3CDCYP1A2
SCHEMBL4302508 0.73 HTR6 (0.46) AHRHTR6CCR10DHPSPIP4K2A
SCHEMBL3791954 0.73 AHR (0.43) AHRHTR6DHPSPIK3CDPIP4K2A
Hydrochloric Acid SCHEMBL28245580 0.73 TTR (0.46) AHRHTR6DHPSPIK3CDCYP1A2

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-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 US claimed
US-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2011-09-22 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 (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-20110230350-A1 ARYL-AND HETARYLSULFONAMIDES AS ACTIVE INGREDIENTS AGAINST ABIOTIC PLANT STRESS STS, ARSA, TST AHR 17/4885HTR6 1828/4885CCR10 4817/4885

“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.