SCHEMBL26969732

SCHEMBL26969732

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

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 13/20 0.47
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
NPC1 O15118 1/20 0.41
TACR1 P25103 2/20 0.40
GNRHR P30968 1/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL26969778 0.87 NPY5R (0.49) NPY5RNPC1TACR1PRSS1PRSS2
SCHEMBL26969733 0.87 NPY5R (0.60) NPY5RTACR1PRSS1PRSS2PRSS3
SCHEMBL26969717 0.83 NPY5R (0.41) NPY5RTACR1GNRHRPRSS1PRSS2
SCHEMBL26969772 0.83 NPY5R (0.41) NPY5RTACR1GNRHRPRSS1PRSS2
SCHEMBL25274911 0.83 NPY5R (0.43) NPY5RTACR1GNRHR
SCHEMBL26969744 0.83 HTR6 (0.40) NPY5RTACR1GNRHR
SCHEMBL25281945 0.82 HTR6 (0.38) NPY5RTACR1GNRHR
SCHEMBL26969704 0.81 NPY5R (0.43) NPY5RTACR1GNRHR
SCHEMBL26969730 0.80 KCNH2 (0.46) NPY5RTACR1GNRHR
SCHEMBL26969711 0.79 NPY5R (0.42) NPY5RTACR1GNRHRPRSS1PRSS2

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 681/4885PSEN1 1898/4885PSEN2 1571/4885

“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.