SCHEMBL514990

SCHEMBL514990

COCc1ccccc1SC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 4/20 0.46
CHRM2 P08172 1/20 0.46
HPGD P15428 3/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.38
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
APOBEC3G Q9HC16 1/20 0.35
IDO1 P14902 2/20 0.35
POLB P06746 1/20 0.35
PDK2 Q15119 1/20 0.35

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
SCHEMBL8216340 0.84 KMT2A (0.44) ALDH1A1MAPTL3MBTL1LMNAKMT2A
SCHEMBL945019 0.84 APOBEC3G (0.52) ALDH1A1MAPTL3MBTL1LMNAKMT2A
SCHEMBL514989 0.81 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL9090944 0.80 LMNA (0.36) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL30688230 0.80 HPGD (0.46) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL648491 0.78 IDO1 (0.44) ALDH1A1MAPTCHRM2KMT2ATDP1
SCHEMBL3149092 0.78 L3MBTL1 (0.44) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL515495 0.76 L3MBTL1 (0.47) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL515494 0.76 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1LMNACHRM2
SCHEMBL10172753 0.75 ALDH1A1 (0.60) ALDH1A1MAPTL3MBTL1LMNACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
WO-2014184071-A1 MIXTURES OF HALOALKYLSULFONANILIDE DERIVATIVES AND HERBICIDES SYNGENTA LIMITED (GB) 2014-11-20 WO disclosed
WO-2014184070-A1 MIXTURES OF HALOALKYLSULFONANILIDE DERIVATIVES AND HERBICIDES SYNGENTA LIMITED (GB) 2014-11-20 WO disclosed
EP-2420493-A1 HALOALKYLSULFONANILIDE DERIVATIVE Nissan Chemical Industries, Ltd. (JP) 2012-02-22 EP disclosed
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-02-02 US disclosed
EP-2336104-A1 ORTHO-SUBSTITUTED HALOALKYLSULFONANILIDE DERIVATIVE AND HERBICIDE Nissan Chemical Industries, Ltd. (JP) 2011-06-22 EP disclosed
US-7342031-B2 Thiadiazole compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-11 US disclosed
US-20070293510-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED ( A JAPANESE CORPORATION) (JP) 2007-12-20 US disclosed
US-7273879-B2 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-25 US disclosed
US-20060014962-A1 Thiadiazole compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-01-19 US disclosed
US-20050215578-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-09-29 US disclosed
EP-1550661-A1 THIADIAZOLE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2005-07-06 EP disclosed
EP-1475374-A1 THIADIAZOLE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-10 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 (4 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-20050215578-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH ALDH1A1 654/4885MAPT 4618/4885L3MBTL1 26/4885
US-20120029187-A1 HALOALKYLSULFONANILIDE DERIVATIVE CBR3, CBR1, HDHD5 ALDH1A1 1574/4885MAPT 4824/4885L3MBTL1 118/4885
US-20060014962-A1 Thiadiazole compound and use thereof CBR3, TH, CYP2E1 ALDH1A1 279/4885MAPT 3930/4885L3MBTL1 68/4885
US-20070293510-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH ALDH1A1 683/4885MAPT 4589/4885L3MBTL1 25/4885

“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.