SCHEMBL21034360

SCHEMBL21034360

O=S(=O)(F)n1c(Cl)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
ALDH3A1 P30838 7/20 0.51
NOD1 Q9Y239 8/20 0.48
CXCL8 P10145 3/20 0.48
NOD2 Q9HC29 2/20 0.48
LMNA P02545 4/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 2/20 0.43

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
SCHEMBL7837246 0.82 SMN1; SMN2 (0.56) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL28063595 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL22462449 0.82 SMN1; SMN2 (0.66) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL3490377 0.78 SMN1; SMN2 (0.74) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL24696307 0.76 KDM4E (0.49) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL7837525 0.70 GAA (0.61) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2
SCHEMBL24695992 0.69 NOD1 (0.55) SMN1; SMN2ALDH3A1NOD1LMNAKDM4E
SCHEMBL66294 0.69 SMN1; SMN2 (0.63) SMN1; SMN2NOD1CXCL8NOD2LMNA
SCHEMBL1053419 0.69 SMN1; SMN2 (1.00) SMN1; SMN2LMNAKDM4EALDH1A1TSHR
SCHEMBL3634978 0.68 SMN1; SMN2 (0.66) SMN1; SMN2ALDH3A1NOD1CXCL8NOD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3715342-B1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF ZHONGHONGXIN INVEST HOLDINGS SHENZHEN CO LTD (CN) 2024-08-07 EP disclosed
US-11091442-B2 Fluorosulfonyl-containing compound, intermediate thereof, preparation method therefor and use thereof SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2021-08-17 US disclosed
US-11091442-B2 Fluorosulfonyl-containing compound, intermediate thereof, preparation method therefor and use thereof SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2021-08-17 US disclosed
US-11046653-B2 2021-06-29 US disclosed
US-11046653-B2 2021-06-29 US disclosed
US-20200369619-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2020-11-26 US disclosed
US-20200369619-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2020-11-26 US disclosed
EP-3715342-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2020-09-30 EP disclosed
CN-107857730-B A kind of fluorosulfonyl group-containing compound, wherein mesosome, preparation method and application 中国科学院上海有机化学研究所 2019-10-15 CN disclosed
WO-2019101132-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海有机化学研究所 2019-05-31 WO 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 (3 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-11046653-B2 CYP4F11, NOTUM, CYP2F1 SMN1; SMN2 2893/4885ALDH3A1 342/4885NOD1 1166/4885
US-20200369619-A1 FLUOROSULFONYL-CONTAINING COMPOUND, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, NOTUM, WEE2 SMN1; SMN2 3296/4885ALDH3A1 400/4885NOD1 329/4885
US-11091442-B2 Fluorosulfonyl-containing compound, intermediate thereof, preparation method therefor and use thereof WEE1, NOTUM, WEE2 SMN1; SMN2 3296/4885ALDH3A1 400/4885NOD1 329/4885

“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.