SCHEMBL6452972

SCHEMBL6452972

CNC(=O)/C(=N/OC)c1ccccc1COc1ccc(Cl)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 8/20 0.61
HIF1A Q16665 6/20 0.53
ADRB2 P07550 1/20 0.47
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL8371588 1.00 MRGPRX4 (0.61) MRGPRX4HIF1AADRB2TSHRTDP1
SCHEMBL6452979 1.00 MRGPRX4 (0.61) MRGPRX4HIF1AADRB2TSHRTDP1
SCHEMBL8371706 0.92 HIF1A (0.53) MRGPRX4HIF1ATP53HTT
SCHEMBL8371708 0.92 HIF1A (0.53) MRGPRX4HIF1ATP53HTT
SCHEMBL8369903 0.91 HIF1A (0.52) MRGPRX4HIF1A
SCHEMBL8621954 0.91 HIF1A (0.48) MRGPRX4HIF1ATP53HTT
SCHEMBL8621955 0.91 HIF1A (0.48) MRGPRX4HIF1ATP53HTT
SCHEMBL6457931 0.91 HIF1A (0.52) MRGPRX4HIF1A
SCHEMBL6457937 0.91 HIF1A (0.52) MRGPRX4HIF1A
SCHEMBL8618455 0.90 MRGPRX4 (0.65) MRGPRX4HIF1AADRB2TP53HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030055096-A1 Fungicidal composition OGURI YUKIO (JP) 2003-03-20 US claimed
EP-0741970-A1 BACTERICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-11-13 EP claimed
US-6838482-B2 Fungicidal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-04 US disclosed
US-20030055096-A1 Fungicidal composition OGURI YUKIO (JP) 2003-03-20 US disclosed
EP-0644183-B1 Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1999-06-02 EP disclosed
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
EP-0741970-A1 BACTERICIDAL COMPOSITION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-11-13 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed
EP-0644183-A2 Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1995-03-22 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-20030055096-A1 Fungicidal composition CBR1, CBR3, CYP1B1 MRGPRX4 1359/4885HIF1A 2640/4885ADRB2 1989/4885

“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.