SCHEMBL26969738

SCHEMBL26969738

O=C(CC1CCOC1)N1CCC2(CC1)CN(S(=O)(=O)c1ccc(C(F)F)cc1)c1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 9/20 0.42
RORC P51449 3/20 0.39
ACLY P53396 1/20 0.39
GNRHR P30968 1/20 0.37
TACR1 P25103 3/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
NR1I2 O75469 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
NAMPT P43490 1/20 0.35

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
SCHEMBL26969772 0.92 NPY5R (0.41) NPY5RACLYGNRHRTACR1PRSS1
SCHEMBL26969741 0.86 NPY5R (0.40) NPY5RACLYGNRHRTACR1PRSS1
SCHEMBL26969711 0.85 NPY5R (0.42) NPY5RACLYGNRHRTACR1PRSS1
SCHEMBL26969733 0.81 NPY5R (0.60) NPY5RTACR1PRSS1PRSS2PRSS3
SCHEMBL26969704 0.81 NPY5R (0.43) NPY5RGNRHRTACR1
SCHEMBL26969717 0.81 NPY5R (0.41) NPY5RACLYGNRHRTACR1PRSS1
SCHEMBL26969740 0.80 HTT (0.49) NPY5RACLYNAMPT
SCHEMBL26969775 0.80 NPC1L1 (0.42) NPY5RGNRHRTACR1
SCHEMBL26969778 0.79 NPY5R (0.49) NPY5RTACR1PRSS1PRSS2PRSS3
SCHEMBL26969732 0.79 NPY5R (0.47) NPY5RGNRHRTACR1PRSS1PRSS2

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-20230416262-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-12-28 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-20230416262-A1 TRPML MODULATORS TRPM2, TRPM4, TRPM5 NPY5R 681/4885RORC 2737/4885ACLY 3265/4885

“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.