SCHEMBL21690528

SCHEMBL21690528

CCc1cccc2c(OCC3CC3)c(F)ccc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.38
▸ HTR4 Q13639 3/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ HTR7 P34969 2/20 0.37
▸ HTR2B P41595 2/20 0.37
▸ HTR3A P46098 2/20 0.37
▸ MTNR1A P48039 1/20 0.36
▸ HTR1A P08908 1/20 0.35
▸ PARP15 Q460N3 1/20 0.34
▸ PARP10 Q53GL7 1/20 0.34
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34
▸ RBP4 P02753 1/20 0.32
▸ TTR P02766 1/20 0.32
▸ ACACA Q13085 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 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 0.83 CYP1A2 (0.38) RIPK1HTR4HTR2CHTR7HTR2B
SCHEMBL21690530 0.81 FFAR4 (0.38) HTR4HTR2CHTR7HTR2BHTR3A
SCHEMBL21325057 0.80 RIPK1 (0.37) RIPK1HTR4HTR2CHTR7HTR2B
SCHEMBL21534011 0.78 HTR2C (0.36) HTR4HTR2CHTR7HTR2BHTR3A
SCHEMBL21325059 0.77 PDE3B (0.35) HTR4HTR2CHTR7HTR2BHTR3A
SCHEMBL24180084 0.75 RIPK1 (0.37) RIPK1PARP15PARP10ALOX5APFEN1
SCHEMBL21690529 0.74 ALOX5AP (0.34) HTR4HTR2CHTR7HTR2BHTR3A
SCHEMBL22371226 0.72 MAOB (0.40) RIPK1HTR2CHTR2BALOX5APFEN1
SCHEMBL30468385 0.72 MAOB (0.40) RIPK1HTR2CHTR2BALOX5APFEN1
SCHEMBL22390611 0.71 RIPK1 (0.60) RIPK1HTR4HTR2CHTR7HTR2B

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 RIPK1 3431/4885HTR4 4094/4885HTR2C 4038/4885
US-11247984-B2 Uracil containing compounds UNG, DPYD, DUT RIPK1 3431/4885HTR4 4094/4885HTR2C 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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