SCHEMBL21690529

SCHEMBL21690529

CCc1cnnc2c(OCC3CC3)c(F)ccc12

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 4/20 0.34
▸ FEN1 P39748 4/20 0.34
▸ HTR2C P28335 2/20 0.32
▸ HTR7 P34969 2/20 0.32
▸ HTR2B P41595 2/20 0.32
▸ HTR3A P46098 2/20 0.32
▸ HTR4 Q13639 2/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ PARP15 Q460N3 1/20 0.32
▸ PARP10 Q53GL7 1/20 0.32
▸ TLR9 Q9NR96 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ FFAR4 Q5NUL3 3/20 0.30
▸ HCAR2 Q8TDS4 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
SCHEMBL21534011 0.82 HTR2C (0.36) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL21325060 0.81 ALOX5AP (0.33) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL21690530 0.80 FFAR4 (0.38) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL21690528 0.74 RIPK1 (0.38) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL21325056 0.72 ALOX5AP (0.34) ALOX5APFEN1CYP11B1CYP11B2FFAR4
SCHEMBL20202028 0.71 PIK3R1 (0.39) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL24180084 0.71 RIPK1 (0.37) ALOX5APFEN1PARP15PARP10FFAR4
SCHEMBL21325059 0.70 PDE3B (0.35) ALOX5APFEN1HTR2CHTR7HTR2B
SCHEMBL20204677 0.69 PDE2A (0.37) ALOX5APFEN1PARP15PARP10FFAR4
SCHEMBL21325055 0.68 RIPK1 (0.33) ALOX5APFEN1HTR2CHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11247984-B2 Uracil containing compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2022-02-15 — — US disclosed
US-20200039966-A1 URACIL CONTAINING COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-02-06 — — 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 (2 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-20200039966-A1 URACIL CONTAINING COMPOUNDS UNG, DPYD, DUT ALOX5AP 2695/4885FEN1 21/4885HTR2C 4038/4885
US-11247984-B2 Uracil containing compounds UNG, DPYD, DUT ALOX5AP 2695/4885FEN1 21/4885HTR2C 4038/4885

“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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