SCHEMBL6795763

SCHEMBL6795763

CCOC(=O)c1cc2c(C(F)(F)F)cc(OCCCS(=O)(=O)O)cc2n1C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAOA P21397 1/20 0.37
PLA2G2A P14555 2/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
ALOX5 P09917 1/20 0.34
MCL1 Q07820 1/20 0.33
PGR P06401 1/20 0.32
AR P10275 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HRH2 P25021 1/20 0.32
HRH1 P35367 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL6797980 0.95 POLB (0.38) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL6799070 0.86 POLB (0.41) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL6799072 0.86 GAA (0.41) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL7877960 0.85 HPGD (0.45) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL6798204 0.82 KDM4E (0.35) KDM4EALDH1A1HPGDALOX5PGR
SCHEMBL6798564 0.82 LDHA (0.36) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL6796884 0.82 AGER (0.40) POLBGAAMAOAKDM4EALDH1A1
SCHEMBL6798688 0.81 PLA2G2A (0.34) POLBPLA2G2AKDM4EALDH1A1MCL1
SCHEMBL6797518 0.80 KDM4E (0.40) KDM4EALDH1A1HPGDALOX5SMN1; SMN2
SCHEMBL7873290 0.80 DYRK1A (0.43) POLBGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6734205-B2 SODIUM CHANNEL MODERATORS; CARDIOVASCULAR DISORDERS; ANTIDIABETIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2004-05-11 US disclosed
US-20030018056-A1 Substituted guanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2003-01-23 US disclosed
EP-1238971-A1 SUBSTITUTED GUANIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-09-11 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 (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-20030018056-A1 Substituted guanidine derivatives SLC28A1, SLC7A1, ABCB11 POLB 1536/4885GAA 292/4885MAOA 831/4885

“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.