SCHEMBL20830739

SCHEMBL20830739

O=C(OCc1ccccc1)c1ccc(Cl)c(OCc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.57
RXRA P19793 1/20 0.57
RXRB P28702 1/20 0.57
KMT2A Q03164 2/20 0.57
SLC6A2 P23975 1/20 0.57
SLC6A3 Q01959 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
LMNA P02545 2/20 0.56
MRGPRX4 Q96LA9 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
ALDH1A1 P00352 4/20 0.53
MAPT P10636 2/20 0.53
TP53 P04637 2/20 0.53
MEN1 O00255 1/20 0.53
MITF O75030 1/20 0.53
XBP1 P17861 1/20 0.53
NFKB1 P19838 1/20 0.53

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
SCHEMBL20831013 0.91 KDM4E (0.56) HPGDRXRARXRBKMT2ASLC6A2
SCHEMBL16584995 0.89 MRGPRX4 (0.58) HPGDRXRARXRBKMT2ASLC6A2
SCHEMBL559537 0.87 NOTUM (0.58) HPGDRXRARXRBKMT2ALMNA
SCHEMBL23182920 0.87 RAB9A (0.50) HPGDRXRARXRBKMT2ASLC6A2
SCHEMBL1934576 0.87 HPGD (0.70) HPGDRXRARXRBKMT2AMRGPRX4
SCHEMBL3960907 0.87 KMT2A (0.62) HPGDRXRAKMT2ASLC6A2SLC6A3
SCHEMBL30141105 0.87 KMT2A (0.62) HPGDRXRAKMT2ASLC6A2SLC6A3
SCHEMBL9574663 0.85 MRGPRX4 (0.60) HPGDRXRARXRBKMT2ASLC6A2
SCHEMBL22015271 0.84 LMNA (0.62) HPGDKMT2ASLC6A2SLC6A3TDP1
SCHEMBL20482380 0.83 KMT2A (0.57) HPGDKMT2ASLC6A2SLC6A3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230011968-A1 TRIAZINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2023-01-12 US disclosed
EP-3456713-A1 PROCESS FOR THE PREPARATION OF TRIAZINE DERIVATIVES Japan Tobacco Inc. (JP) 2019-03-20 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-20230011968-A1 TRIAZINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF PTGIS, PTGS1, PTGES HPGD 60/4885RXRA 2387/4885RXRB 2658/4885

“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.