SCHEMBL6096429

SCHEMBL6096429

O=C1C=C(Cl)C(=O)C(c2c[nH]c3ccc(F)cc23)=C1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.44
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
PDGFRA P16234 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
TEK Q02763 1/20 0.44
KDM4E B2RXH2 1/20 0.41
GPR84 Q9NQS5 2/20 0.40
MAP3K14 Q99558 1/20 0.40
MPO P05164 2/20 0.38
SLC6A4 P31645 2/20 0.38
TSHR P16473 1/20 0.38
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
CAMK2D Q13557 1/20 0.37
ATP4A P20648 1/20 0.37
ATP4B P51164 1/20 0.37

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
SCHEMBL6095486 0.90 TDO2 (0.46) GPR84IDO1
SCHEMBL6098311 0.86 F7 (0.43) GPR84MAP3K14SLC6A4HTR1AHTR7
SCHEMBL6098129 0.84 EGFR (0.44) IGF1RPDGFRBKITPDGFRAFLT1
SCHEMBL6094987 0.84 MEN1 (0.41) PDGFRBKDM4ESLC6A4HTR1AHTR7
SCHEMBL6095976 0.84 TSHR (0.39) PDGFRBKITKDRKDM4ESLC6A4
SCHEMBL6094431 0.81 KDR (0.50) KDRKDM4EGPR84MAP3K14SLC6A4
SCHEMBL6097734 0.81 PRKCB (0.54) PDGFRBCAMK2DPIM1
SCHEMBL6094956 0.78 ALDH1A1 (0.43) GPR84SLC6A4CAMK2DPIM1IDO1
SCHEMBL6098483 0.76 MEN1 (0.40) CAMK2DATP4AATP4BPIM1IDO1
SCHEMBL6094623 0.76 IMPDH2 (0.45) CAMK2DIDO1

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-7057052-B2 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY (US) 2006-06-06 US disclosed
WO-2004050014-A2 SETEROCYCLIC QUINONES AS PHARMACEUTICAL AGENTS DUKE UNIVERSITY (US) 2004-06-17 WO disclosed
US-20040063774-A1 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY 2004-04-01 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-20040063774-A1 Heterocyclic quinones as pharmaceutical agents NQO1, RECQL, SDHA IGF1R 3709/4885PDGFRB 3230/4885KIT 3806/4885

“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.