SCHEMBL21711085

SCHEMBL21711085

CC(C)(C)Cc1ccccc1CP

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.47
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
ESR1 P03372 1/20 0.33
SLC6A2 P23975 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.31
CYP2D6 P10635 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL6685097 0.87 RIPK1 (0.56) RIPK1BCHEACHEESR1SLC6A2
SCHEMBL9718549 0.80 RIPK1 (0.50) RIPK1BCHEACHEESR1SLC6A2
SCHEMBL5598862 0.79 HSPA5 (0.38) BCHETAAR1CYP2D6
SCHEMBL6685032 0.78 RIPK1 (0.48) RIPK1ESR1SLC6A2TAAR1CYP2D6
SCHEMBL13630822 0.76 RIPK1 (0.47) RIPK1BCHEACHEESR1SLC6A2
SCHEMBL358741 0.76 RIPK1 (0.47) RIPK1ESR1SLC6A2TAAR1LMNA
SCHEMBL10318075 0.76 RIPK1 (0.47) RIPK1BCHEACHEESR1SLC6A2
SCHEMBL15285766 0.76 RIPK1 (0.47) RIPK1BCHEACHEESR1SLC6A2
SCHEMBL396630 0.76 RIPK1 (0.47) RIPK1ESR1SLC6A2TAAR1
SCHEMBL13020681 0.76 RIPK1 (0.47) RIPK1BCHEACHEESR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200046738-A1 FATTY ACID ACETYLATED SALICYLATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2020-02-13 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 (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-20200046738-A1 FATTY ACID ACETYLATED SALICYLATES AND THEIR USES FASN, ACACA, FABP4 RIPK1 825/4885BCHE 4166/4885ACHE 3588/4885

“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.