SCHEMBL21325057

SCHEMBL21325057

CC(C)(C)c1cccc2c(OCC3CC3)c(F)ccc12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.37
▸ HTR4 Q13639 4/20 0.34
▸ HTR2B P41595 3/20 0.34
▸ HTR3A P46098 3/20 0.34
▸ HTR2C P28335 2/20 0.34
▸ HTR7 P34969 2/20 0.34
▸ RBP4 P02753 2/20 0.34
▸ TTR P02766 1/20 0.34
▸ ALOX5AP P20292 2/20 0.33
▸ FEN1 P39748 2/20 0.33
▸ HTR1A P08908 1/20 0.32
▸ FFAR1 O14842 3/20 0.32

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
SCHEMBL20376461 0.82 CYP1A2 (0.38) RIPK1HTR4HTR2BHTR3AHTR2C
SCHEMBL21325058 0.82 FFAR4 (0.35) RIPK1ALOX5APFEN1
SCHEMBL21690528 0.80 RIPK1 (0.38) RIPK1HTR4HTR2BHTR3AHTR2C
SCHEMBL21325050 0.79 HTR2B (0.35) RIPK1HTR4HTR2BHTR3AHTR2C
SCHEMBL21325503 0.77 FFAR4 (0.33) RIPK1HTR4HTR2BHTR3AHTR2C
SCHEMBL20202029 0.76 RIPK1 (0.33) RIPK1ALOX5APFEN1
SCHEMBL21325060 0.74 ALOX5AP (0.33) RIPK1HTR4HTR2BHTR3AHTR2C
SCHEMBL21325056 0.73 ALOX5AP (0.34) RIPK1ALOX5APFEN1
SCHEMBL20347956 0.73 RIPK1 (0.51) RIPK1HTR2BHTR2CRBP4
SCHEMBL21325055 0.71 RIPK1 (0.33) RIPK1HTR4HTR2BHTR3AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11174271-B2 6-membered uracil isosteres CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-16 — — US disclosed
US-11014924-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-05-25 — — US disclosed
US-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-12-08 — — US disclosed
US-20190330210-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 — — 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 (5 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 RIPK1 3321/4885HTR4 3878/4885HTR2B 3845/4885
US-20190330210-A1 HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, TYMP, DPYD RIPK1 3869/4885HTR4 3019/4885HTR2B 2876/4885
US-10858344-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors DUT, TYMP, DPYD RIPK1 3869/4885HTR4 3019/4885HTR2B 2876/4885
US-11014924-B2 Hydantoin containing deoxyuridine triphosphatase inhibitors DUT, TYMP, DPYD RIPK1 3869/4885HTR4 3019/4885HTR2B 2876/4885
US-20190270756-A1 6-MEMBERED URACIL ISOSTERES UNG, DUT, DPYD RIPK1 3321/4885HTR4 3878/4885HTR2B 3845/4885

“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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