SCHEMBL7207205

SCHEMBL7207205

C#CC(O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TPMT P51580 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 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
SCHEMBL6971362 0.79 ACP3 (0.43) TSHRIDO1
SCHEMBL7204528 0.76 TSHR (0.40) TSHRCYP3A4
SCHEMBL1920526 0.76 TSHR (0.41) TSHRTP53CYP3A4IDO1TDO2
SCHEMBL6058908 0.72 ESR2 (0.40) CYP3A4
SCHEMBL17382854 0.71 ALDH1A1 (0.36) TSHRTPMT
SCHEMBL11487860 0.71 TSHR (0.40) TSHRTP53
SCHEMBL7203638 0.71 AHR (0.41) TSHRTP53CYP3A4IDO1TDO2
SCHEMBL4481321 0.71 TSHR (0.50) TSHRTP53CYP3A4TPMTIDO1
SCHEMBL29184903 0.71 ESR1 (0.46) TSHR
SCHEMBL14613748 0.68 CA1 (0.42) CYP3A4

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
CN-107848976-B Alkynyl pyridine prolyl hydroxylase inhibitor, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2020-11-17 CN disclosed
US-6605730-B2 3-(2-Thienyl)-5-phenyl-1H-pyrazole compounds of given formula NIHON BAYER AGROCHEM K.K. (JP) 2003-08-12 US disclosed
US-20030028034-A1 Nematicidal pyrazoles WADA KATSUAKI (JP) 2003-02-06 US disclosed
US-6310049-B1 3-(2-THIENYL),5-(SUBSTITUTED PHENYL)-1H-PYRAZOLES AND 3-(SUBSTITUTED PHENYL),5-(2-THIENYL)-1H-PYRAZOLES OF GIVEN FORMULA; ANTHELMINTICS NIHON BAYER AGROCHEM K.K. (JP) 2001-10-30 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-20030028034-A1 Nematicidal pyrazoles CBR3, CBR1, CCR4 TSHR 1691/4885TP53 4681/4885CYP3A4 28/4885

“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.