SCHEMBL5883674

SCHEMBL5883674

O=CCCNS(=O)(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.63
KDM4E B2RXH2 1/20 0.63
LMNA P02545 1/20 0.63
PKM P14618 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
TBXA2R P21731 2/20 0.54
KEAP1 Q14145 1/20 0.53
MAPK1 P28482 2/20 0.53
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
GBA1 P04062 1/20 0.49
TPSAB1 Q15661 1/20 0.48

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
SCHEMBL8349568 0.83 ALDH1A1 (0.79) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL9812992 0.83 ALDH1A1 (0.61) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL6008086 0.83 ALDH1A1 (0.67) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL12672473 0.82 ALDH1A1 (0.70) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL12672466 0.82 ALDH1A1 (0.70) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL18205274 0.81 ALDH1A1 (0.62) ALDH1A1LMNACA2TSHRGBA1
SCHEMBL3934921 0.80 ALDH1A1 (0.57) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL6006902 0.80 ALDH1A1 (0.57) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL10453840 0.79 ALDH1A1 (0.96) ALDH1A1KDM4ELMNAPKMSMN1; SMN2
SCHEMBL12640170 0.78 ALDH1A1 (0.78) ALDH1A1KDM4ELMNAPKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102127023-B 7-membered ring compound, process for producing the same, and use thereof DAIICHI SANKYO CO LTD 2013-02-06 CN disclosed
US-20060287338-A1 Metalloproteinase inhibitor compounds ASTRAZENECA AB (SE) 2006-12-21 US disclosed
US-7122551-B2 Metalloproteinase inhibitor compounds ASTRAZENECA AB (SE) 2006-10-17 US disclosed
US-6734183-B2 USEFUL AS METALLOPROTEINASE INHIBITOR; PIPERAZINO-SULFONAMIDE OR PIPERIDINO-SULFONAMIDE COMPOUND ASTRAZENECA AB (SE) 2004-05-11 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-20060287338-A1 Metalloproteinase inhibitor compounds TIMP3, MMP2, MMP13 ALDH1A1 452/4885KDM4E 2180/4885LMNA 1250/4885

“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.