SCHEMBL6704023

SCHEMBL6704023

O=C1c2c(Cl)cccc2OC1Cl

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.36
CES1 P23141 1/20 0.35
AHR P35869 2/20 0.34
RET P07949 2/20 0.33
GRK5 P34947 1/20 0.33
TYRO3 Q06418 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
ITGB1 P05556 4/20 0.33
ITGA2 P17301 4/20 0.33
PBRM1 Q86U86 3/20 0.33
GUSB P08236 1/20 0.33
DAO P14920 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
KDR P35968 1/20 0.32
GRIA1 P42261 1/20 0.32
CACNG8 Q8WXS5 1/20 0.32
P2RY6 Q15077 1/20 0.31

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
SCHEMBL11300615 0.79 BCHE (0.46) HTT
SCHEMBL8948577 0.73 TTR (0.32) TTRCES1GUSB
Alcohol SCHEMBL8473894 0.63 AHR (0.36) AHRTSHRHTT
SCHEMBL9780105 0.63 TSHR (0.40) TTRCES1AHRRETGRK5
SCHEMBL259173 0.63 CES1 (0.36) CES1AHRRETGRK5TYRO3
SCHEMBL259172 0.63 CES1 (0.36) CES1AHRRETGRK5TYRO3
SCHEMBL4260328 0.63 SMARCA2 (0.37) CES1PBRM1DAOHTTCACNG8
SCHEMBL2471569 0.62 TSHR (0.57) CES1RETGRK5TYRO3DYRK1B
SCHEMBL8809006 0.62 PBRM1 (0.36) CES1RETGRK5TYRO3DYRK1B
SCHEMBL4496746 0.61 PBRM1 (0.39) CES1PBRM1TSHRHTTGRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040199014-A1 Method for producing 2-(hydroxyphenyl)-2-(alkoxyimino)-n-methylacetamide derivatives BAYER CROPSCIENCE AG (DE) 2004-10-07 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-20040199014-A1 Method for producing 2-(hydroxyphenyl)-2-(alkoxyimino)-n-methylacetamide derivatives HMOX2, AADAC, HNMT TTR 2596/4885CES1 3113/4885AHR 759/4885

“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.