SCHEMBL26969720

SCHEMBL26969720

O=C(C1CCC2(CC1)CN(S(=O)(=O)c1ccc(C(F)F)cc1)c1ccccc12)N1CCC2(CCOC2)C1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.40
NPY5R Q15761 13/20 0.38
HTT P42858 1/20 0.38
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
RORC P51449 1/20 0.35
GNRHR P30968 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL26969692 0.94 NPY5R (0.39) ACLYNPY5RHTTRORCGNRHR
SCHEMBL26969740 0.88 HTT (0.49) ACLYNPY5RHTTMMP2MMP13
SCHEMBL26969704 0.85 NPY5R (0.43) NPY5RGNRHR
SCHEMBL26969770 0.85 NPY5R (0.40) NPY5RHTTRORCGNRHR
SCHEMBL26969736 0.84 NPC1 (0.45) NPY5RHTTGNRHRL3MBTL1ALDH1A1
SCHEMBL25274228 0.80 NPY5R (0.46) ACLYNPY5RGNRHRALDH1A1SMN1; SMN2
SCHEMBL26969738 0.76 NPY5R (0.42) ACLYNPY5RRORCGNRHR
SCHEMBL25274911 0.76 NPY5R (0.43) NPY5RGNRHRALDH1A1
SCHEMBL25239332 0.76 NPY5R (0.47) NPY5R
SCHEMBL26969711 0.75 NPY5R (0.42) ACLYNPY5RGNRHR

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 ACLY 3265/4885NPY5R 681/4885HTT 1696/4885

“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.