SCHEMBL6646408

SCHEMBL6646408

O=C(NC(=O)c1ccc(F)c(OC(F)F)c1F)NC1CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
EPHX2 P34913 3/20 0.39
EPHX1 P07099 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 2/20 0.36
PPIA P62937 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ADRA2A P08913 1/20 0.35
MCHR1 Q99705 1/20 0.35

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
SCHEMBL6644785 0.85 MAPK1 (0.47) MAPK1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL6644570 0.79 ALDH1A1 (0.39) EPHX2EPHX1MEN1KMT2ASMN1; SMN2
SCHEMBL4516474 0.72 MAPK1 (0.49) MAPK1ALDH1A1HPGDKDM4E
SCHEMBL7645833 0.72 HPGD (0.55) EPHX2SMN1; SMN2ALDH1A1L3MBTL1HPGD
SCHEMBL8044966 0.71 CES2 (0.43) MEN1KMT2ASMN1; SMN2ALDH1A1HPGD
SCHEMBL6643313 0.70 CES2 (0.41) KMT2AALDH1A1
SCHEMBL6646405 0.70 HPGD (0.43) MAPK1EPHX2EPHX1MEN1KMT2A
SCHEMBL6647834 0.70 MAPK1 (0.56) MAPK1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13332426 0.67 NPC1 (0.60) EPHX1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL4514409 0.67 POLB (0.50) MAPK1EPHX2EPHX1MEN1KMT2A

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
EP-1401830-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2004-03-31 EP disclosed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US disclosed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 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 (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-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance ABCC1, RPS6KA1, SIGMAR1 MAPK1 544/4885EPHX2 4469/4885EPHX1 3869/4885

“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.