SCHEMBL19664009

SCHEMBL19664009

CC1=CC=C2C(=Cc3ccccc32)C1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.37
DRD2 P14416 3/20 0.31
DRD4 P21917 3/20 0.31
CDC25A P30304 1/20 0.30
CDC25B P30305 1/20 0.30

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
SCHEMBL19664007 0.77 PTGS2 (0.34) PTGS2DRD2DRD4
SCHEMBL23242597 0.74 PTGS2 (0.32) PTGS2
SCHEMBL710125 0.72 PTGS2 (0.34) PTGS2DRD2DRD4CDC25ACDC25B
SCHEMBL30502984 0.72 PTGS2 (0.34) PTGS2DRD2DRD4CDC25ACDC25B
Hydrochloric Acid SCHEMBL7372695 0.71 BCAT2 (0.32)
SCHEMBL3932147 0.67 PTGS2 (0.30) PTGS2
SCHEMBL10354666 0.65 ABCG2 (0.39) DRD2DRD4CDC25ACDC25B
SCHEMBL5886591 0.65 ABCG2 (0.39) DRD2DRD4CDC25ACDC25B
SCHEMBL19745040 0.65 PTGS2 (0.40) PTGS2DRD2DRD4CDC25ACDC25B
SCHEMBL9501499 0.64 NISCH (0.30) DRD2DRD4

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
US-10280238-B2 Transition metal compound, catalyst composition comprising same, and method for producing olefin polymer using same LG CHEM, LTD. (KR) 2019-05-07 US disclosed
EP-3252061-B1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING SAME, AND METHOD FOR PRODUCING OLEFIN POLYMER USING SAME LG CHEMICAL LTD (KR) 2019-03-20 EP disclosed
US-20180105616-A1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING SAME, AND METHOD FOR PRODUCING OLEFIN POLYMER USING SAME LG CHEM, LTD. (KR) 2018-04-19 US disclosed
EP-3252061-A1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING SAME, AND METHOD FOR PRODUCING OLEFIN POLYMER USING SAME LG Chem, Ltd. (KR) 2017-12-06 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-10280238-B2 Transition metal compound, catalyst composition comprising same, and method for producing olefin polymer using same NOTUM, SOAT2, SOAT1 PTGS2 1413/4885DRD2 3771/4885DRD4 3402/4885

“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.