SCHEMBL6672115

SCHEMBL6672115

Cc1c(F)c(N2CCCC2)c(C)c2c1c(=O)[nH]c(=O)n2C1CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
PKM P14618 1/20 0.36
EPHX2 P34913 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
KCNH2 Q12809 2/20 0.31
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30
TPH1 P17752 1/20 0.30
TPH2 Q8IWU9 1/20 0.30

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
SCHEMBL6671122 0.90 CCNC (0.35) ALDH1A1TSHRLMNAKCNH2TPH1
SCHEMBL6668985 0.89 ALDH1A1 (0.39) ALDH1A1PKMMEN1LMNAKMT2A
SCHEMBL6674262 0.87 ALDH1A1 (0.33) ALDH1A1PKMEPHX2NPSR1MAPT
SCHEMBL6668532 0.87 ALDH1A1 (0.33) ALDH1A1PKMEPHX2NPSR1MAPT
SCHEMBL6670133 0.86 PIM3 (0.38) ALDH1A1KCNH2
SCHEMBL6673140 0.84 KCNH2 (0.35) KCNH2
SCHEMBL6671662 0.84 ALDH1A1 (0.33) ALDH1A1NPSR1TSHRMEN1LMNA
SCHEMBL7097575 0.83 KCNH2 (0.35) KCNH2
SCHEMBL6669337 0.82 TYMP (0.37) ALDH1A1NPSR1TSHRMEN1KMT2A
SCHEMBL6670927 0.82 KCNH2 (0.36) KCNH2

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 4 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 claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US claimed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 WO claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 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 (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 ALDH1A1 781/4885PKM 1207/4885EPHX2 4469/4885

“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.