SCHEMBL25231978

SCHEMBL25231978

O=S1(=O)CCC2(CC1)CN(S(=O)(=O)c1ccc(C(F)F)cc1)c1ccccc12

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.40
NPY5R Q15761 17/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL30733398 0.91 ACLY (0.43) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL30733427 0.90 ACLY (0.42) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL26969776 0.88 ACLY (0.41) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL25237936 0.86 ACLY (0.41) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL25237931 0.85 ACLY (0.41) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL30733425 0.83 CYP3A4 (0.43) ACLYNPY5RCYP3A4CYP2D6CYP2C9
SCHEMBL25274228 0.81 NPY5R (0.46) ACLYNPY5R
SCHEMBL26969744 0.80 HTR6 (0.40) ACLYNPY5R
SCHEMBL25274911 0.80 NPY5R (0.43) NPY5R
SCHEMBL26969737 0.79 NPY5R (0.42) ACLYNPY5RMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230416262-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-12-28 US disclosed
EP-4192957-A2 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2023-06-14 EP disclosed
CN-116113698-A TRPML modulators 卡斯玛治疗公司 2023-05-12 CN disclosed
WO-2022032073-A2 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2022-02-10 WO 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 681/4885CYP3A4 2481/4885

“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.