SCHEMBL6802816

SCHEMBL6802816

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

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
LMNA P02545 1/20 0.38
ALOX5 P09917 2/20 0.38
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LDHA P00338 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
AR P10275 2/20 0.35
PGR P06401 1/20 0.34
KMT2A Q03164 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL6804485 0.89 KDM4E (0.37) KDM4ELMNAALOX5ALDH1A1L3MBTL1
SCHEMBL6797977 0.84 ALOX5 (0.44) KDM4ELMNAALOX5ALDH1A1L3MBTL1
SCHEMBL6798023 0.82 ALDH1A1 (0.39) KDM4EALOX5ALDH1A1L3MBTL1LDHA
SCHEMBL6797139 0.81 ALDH1A1 (0.40) KDM4ELMNAALOX5ALDH1A1L3MBTL1
SCHEMBL6798912 0.80 KDM4E (0.37) KDM4ELMNAALOX5ALDH1A1L3MBTL1
SCHEMBL6800234 0.79 KDM4E (0.37) KDM4EALOX5ALDH1A1L3MBTL1LDHA
SCHEMBL27430450 0.79 KDM4E (0.37) KDM4EALOX5ALDH1A1L3MBTL1LDHA
SCHEMBL6798402 0.79 KDM4E (0.37) KDM4EALOX5ALDH1A1L3MBTL1LDHA
SCHEMBL27363674 0.79 ALOX5 (0.48) KDM4ELMNAALOX5ALDH1A1LDHA
SCHEMBL6798564 0.78 LDHA (0.36) KDM4EALOX5ALDH1A1L3MBTL1LDHA

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 KDM4E 1068/4885LMNA 1165/4885ALOX5 2297/4885

“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.