SCHEMBL4986449

SCHEMBL4986449

CS(=O)(=O)c1cccc2nc(S)oc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.35
C1R P00736 2/20 0.35
HTR6 P50406 1/20 0.35
PABPC1 P11940 1/20 0.34
EIF4H Q15056 1/20 0.34
RAB9A P51151 3/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
NPC1 O15118 1/20 0.34
CTSG P08311 2/20 0.33
KLK7 P49862 2/20 0.33
KLK14 Q9P0G3 2/20 0.33
KLK5 Q9Y337 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PTGS2 P35354 1/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL11686944 0.83 TTR (0.39) PRSS1C1RHTR6KMT2AMEN1
SCHEMBL1121456 0.83 CA2 (0.44) PRSS1C1RHTR6KMT2AKDM4E
SCHEMBL1121522 0.76 SMN1; SMN2 (0.54) HTR6KMT2AMEN1ALDH1A1LMNA
SCHEMBL6489417 0.73 ELANE (0.41) ALDH1A1ELANE
SCHEMBL6280579 0.72 ELANE (0.37) ALDH1A1LMNATDP1ELANE
SCHEMBL6212728 0.70 DHODH (0.44) KMT2AKDM4EALDH1A1ELANE
SCHEMBL9304178 0.69 ACHE (0.43) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL5043562 0.69 PSMB8 (0.56) C1RRAB9ANPC1ALDH1A1ELANE
SCHEMBL1121340 0.69 CYP2A6 (0.45) C1RRAB9AKMT2AMEN1NPC1
SCHEMBL6281613 0.69 KDM4E (0.38) RAB9AKMT2ANPC1CTSGKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414066-B2 Amide compounds and medications containing the same technical field KOWA COMPANY LTD. (JP) 2008-08-19 US disclosed
US-7393866-B2 Amide compounds and medications containing the same KOWA COMPANY, LTD. (JP) 2008-07-01 US disclosed
EP-0979823-B1 NOVEL AMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2006-03-29 EP disclosed
US-6969711-B2 Cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2005-11-29 US disclosed
US-20050131001-A1 Novel amide compounds and medications containing the same technical field KOWA COMPANY LTD. (JP) 2005-06-16 US disclosed
US-20050131002-A1 Novel amide compounds and medications containing the same KOWA COMPANY LTD. (JP) 2005-06-16 US disclosed
US-6849647-B1 Amide compounds and medications containing the same technical field KOWA COMPANY, LTD. (JP) 2005-02-01 US disclosed
EP-0987254-B1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME KOWA CO (JP) 2004-12-22 EP disclosed
US-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2004-02-26 US disclosed
EP-0987254-A1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-03-22 EP disclosed
EP-0979823-A1 NOVEL AMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME Kowa Company Ltd. (JP) 2000-02-16 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 (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-20050131001-A1 Novel amide compounds and medications containing the same technical field ACAT2, SULT2A1, ACAT1 PRSS1 1841/4885C1R 3237/4885HTR6 1848/4885
US-20050131002-A1 Novel amide compounds and medications containing the same ACAT2, SULT2A1, ACAT1 PRSS1 2019/4885C1R 3218/4885HTR6 1833/4885
US-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same LCAT, ACAT2, ACAT1 PRSS1 773/4885C1R 833/4885HTR6 4593/4885

“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.