SCHEMBL21324922

SCHEMBL21324922

CC(C)(C)c1ccc(F)c(OC[C@@H]2CCCN2)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB4 P30926 5/20 0.51
▸ CHRNA3 P32297 5/20 0.51
▸ CHRNB2 P17787 1/20 0.49
▸ CHRNA4 P43681 1/20 0.49
▸ LTA4H P09960 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46

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
SCHEMBL21324932 1.00 CHRNB4 (0.51) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL20201668 0.83 CHRNB2 (0.56) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL20201654 0.83 CHRNB2 (0.56) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL21533894 0.80 CHRNB4 (0.38) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL20202148 0.80 GRM2 (0.43) —
SCHEMBL20347951 0.80 DUT (0.42) —
SCHEMBL20376493 0.80 CHRNB4 (0.51) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL20208311 0.80 CHRNB4 (0.51) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL20347946 0.79 DUT (0.46) —
SCHEMBL21325270 0.79 EP300 (0.49) SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11518746-B2 Nitrogen ring linked deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2022-12-06 — — US disclosed
US-11247984-B2 Uracil containing compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2022-02-15 — — US disclosed
US-11174271-B2 6-membered uracil isosteres CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-16 — — US disclosed
US-11168059-B2 Amino sulfonyl compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-09 — — US disclosed
US-11014924-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-05-25 — — US disclosed
US-20210061767-A1 NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-03-04 — — US disclosed
US-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-12-08 — — US disclosed
US-10829457-B2 Nitrogen ring linked deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-11-10 — — US disclosed
US-20200039966-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-02-06 — — US disclosed
US-20190330158-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 — — US disclosed
US-20190330210-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 — — US disclosed
US-20190276410-A1 NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-09-12 — — US disclosed
US-20190270756-A1 6-MEMBERED URACIL ISOSTERES CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-09-05 — — 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 (13 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-11174271-B2 6-membered uracil isosteres UNG, DUT, DPYD CHRNB4 4781/4885CHRNA3 4779/4885CHRNB2 4810/4885
US-20210061767-A1 NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, DPYD, TYMP CHRNB4 4773/4885CHRNA3 4792/4885CHRNB2 4736/4885
US-20190330210-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, TYMP, DPYD CHRNB4 4783/4885CHRNA3 4767/4885CHRNB2 4711/4885
US-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors DUT, TYMP, DPYD CHRNB4 4783/4885CHRNA3 4767/4885CHRNB2 4711/4885
US-11168059-B2 Amino sulfonyl compounds DPYD, DNPEP, DUT CHRNB4 4652/4885CHRNA3 4686/4885CHRNB2 4631/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT CHRNB4 4652/4885CHRNA3 4686/4885CHRNB2 4631/4885
US-10829457-B2 Nitrogen ring linked deoxyuridine triphosphatase inhibitors DUT, DPYD, TYMP CHRNB4 4773/4885CHRNA3 4792/4885CHRNB2 4736/4885
US-11014924-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors DUT, TYMP, DPYD CHRNB4 4783/4885CHRNA3 4767/4885CHRNB2 4711/4885
US-20200039966-A1 URACIL CONTAINING COMPOUNDS UNG, DPYD, DUT CHRNB4 4847/4885CHRNA3 4844/4885CHRNB2 4840/4885
US-11518746-B2 Nitrogen ring linked deoxyuridine triphosphatase inhibitors DUT, DPYD, TYMP CHRNB4 4773/4885CHRNA3 4792/4885CHRNB2 4736/4885
US-11247984-B2 Uracil containing compounds UNG, DPYD, DUT CHRNB4 4847/4885CHRNA3 4844/4885CHRNB2 4840/4885
US-20190276410-A1 NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, DPYD, TYMP CHRNB4 4773/4885CHRNA3 4792/4885CHRNB2 4736/4885
US-20190270756-A1 6-MEMBERED URACIL ISOSTERES UNG, DUT, DPYD CHRNB4 4781/4885CHRNA3 4779/4885CHRNB2 4810/4885

“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.

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