SCHEMBL563082

SCHEMBL563082

Cc1ccc(S(=O)(=O)N(C)F)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.62
MAPT P10636 2/20 0.61
MCOLN3 Q8TDD5 1/20 0.61
C5AR1 P21730 1/20 0.57
CA12 O43570 2/20 0.55
CA9 Q16790 2/20 0.55
GAA P10253 3/20 0.52
ATM Q13315 1/20 0.50
GLA P06280 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
TLR9 Q9NR96 1/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL29963641 0.84 APOBEC3G (0.60) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL30082691 0.84 AGER (0.59) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL26413518 0.81 MAPT (0.65) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL82589 0.81 MAPT (0.65) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL5880406 0.81 MAPT (0.65) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL29283438 0.80 TSHR (0.50) AGERCA12CA9GAACA1
SCHEMBL29290107 0.80 AGER (0.55) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL7022399 0.79 APOBEC3G (0.67) C5AR1CA12CA9LMNAHTR2A
SCHEMBL31729683 0.78 MAPT (0.57) AGERMAPTMCOLN3C5AR1CA12
SCHEMBL6990099 0.78 MAPT (0.61) AGERMAPTMCOLN3C5AR1CA12

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 158 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1240707-C 2-Halo-6-0-substituted ketolide derivatives ABBOTT LAB (US) 2006-02-08 CN claimed
EP-1027362-B1 2-HALO-6-O-SUBSTITUTED KETOLIDE DERIVATIVES ABBOTT LAB (US) 2005-06-29 EP claimed
US-6727229-B2 MACROLIDE ANTIBIOTICS PLAY A THERAPEUTICALLY IMPORTANT ROLE, PARTICULARLY WITH THE EMERGENCE OF NEW PATHOGENS ENANTA PHARMACEUTICALS, INC. 2004-04-27 US claimed
WO-2004016634-A1 Novel 11,12-Substituted Lactone Ketolide Derivatives Having Antibacterial Activity ENANTA PHARMACEUTICALS, INC. (US) 2004-02-26 WO claimed
US-20040038915-A1 NOVEL 11,12-SUBSTITUTED LACTONE KETOLIDE DERIVATIVES HAVING ANTIBACTERIAL ACTIVITY ENANTA PHARMACEUTICALS, INC. 2004-02-26 US claimed
CN-1283199-A 2-Halo-6-0-substituted ketolide derivatives ABBOTT LAB (US) 2001-02-07 CN claimed
US-6124269-A NOVEL ERYTHROMYCIN DERIVATIVE ANTIBIOTIC EFFECTIVE AGAINST GRAM-NEGATIVE BACTERIA AND HAVING LESS POTENTIAL FOR DEVELOPING BACTERIAL DRUG RESISTANCE ABBOTT LABORATORIES (US) 2000-09-26 US claimed
EP-1027362-A1 2-HALO-6-O-SUBSTITUTED KETOLIDE DERIVATIVES Abbott Laboratories (US) 2000-08-16 EP claimed
WO-1999021871-A1 2-HALO-6-O-SUBSTITUTED KETOLIDE DERIVATIVES ABBOTT LABORATORIES (US) 1999-05-06 WO claimed
US-20230272272-A1 Surface Treatment Of Quantum Dots UNITED STATES DEPARTMENT OF ENERGY 2023-08-31 US disclosed
US-9861652-B2 2′ Fluoronucleosides EMORY UNIVERSITY (US) 2018-01-09 US disclosed
US-20160158266-A1 2' FLUORONUCLEOSIDES EMORY UNIVERSITY 2016-06-09 US disclosed
US-9180138-B2 2′-fluoronucleosides UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2015-11-10 US disclosed
CN-101955508-B 6-11 dicycloketone macrolide derivative ENANTA PHARM INC 2015-04-15 CN disclosed
EP-0227472-B1 10 BETA-ALKYNYLESTRENE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1989-10-18 EP disclosed
US-4808578-A ANTICARCINOGENIC AGENTS FARMITALIA CARLO ERBA S. R. L. (IT) 1989-02-28 US disclosed
US-4751245-A Antifungal derivatives of N-(6,6-dimethyl-2-hepten-4-ynyl)-1-naphthalenemethanamine and method of using same E. R. SQUIBB & SONS, INC. (US) 1988-06-14 US disclosed
EP-0251574-A2 Antifungal derivatives of N-(6,6-dimethyl-2-hepten-4-ynyl)-1-naphthalenemethanamine and method of using same E.R. Squibb & Sons, Inc. (US) 1988-01-07 EP disclosed
EP-0227472-A1 10 Beta-alkynylestrene derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1987-07-01 EP disclosed
US-4479901-A Fluorination of carbanions with N-fluoro-N-alkylsulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-30 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 (2 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-20160158266-A1 2' FLUORONUCLEOSIDES PNP, BCL3, NPC1 AGER 4395/4885MAPT 4745/4885MCOLN3 2385/4885
US-20040038915-A1 NOVEL 11,12-SUBSTITUTED LACTONE KETOLIDE DERIVATIVES HAVING ANTIBACTERIAL ACTIVITY CYP51A1, SI, VIP AGER 3823/4885MAPT 4299/4885MCOLN3 2789/4885

“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.