SCHEMBL23536124

SCHEMBL23536124

CN(C)S(=O)(=O)c1ccc(S(=O)(=O)Cc2ccccc2N2CCC(c3ccc(Cl)cc3F)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GRM2 Q14416 5/20 0.38
HTT P42858 3/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
CNR1 P21554 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
CCR5 P51681 3/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL29931867 1.00 TSHR (0.39) TSHRNPSR1GRM2HTTLMNA
SCHEMBL29931848 0.90 GRM2 (0.39) TSHRNPSR1GRM2SMN1; SMN2GAA
SCHEMBL29931966 0.90 TSHR (0.43) TSHRNPSR1GRM2HTTLMNA
SCHEMBL23536165 0.90 TSHR (0.43) TSHRNPSR1GRM2HTTLMNA
SCHEMBL23536658 0.87 KMT2A (0.40) TSHRNPSR1HTTLMNASMN1; SMN2
SCHEMBL23536136 0.87 TSHR (0.38) TSHRNPSR1GRM2HTTLMNA
SCHEMBL29932103 0.87 TSHR (0.38) TSHRNPSR1GRM2HTTLMNA
SCHEMBL24628362 0.87 LMNA (0.46) TSHRNPSR1GRM2HTTLMNA
SCHEMBL29772887 0.87 LMNA (0.46) TSHRNPSR1GRM2HTTLMNA
SCHEMBL23536003 0.86 GPR55 (0.38) TSHRNPSR1GRM2HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230104936-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. 2023-04-06 US disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 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-20230104936-A1 TRPML MODULATORS TRPM2, TRPM4, TRPM5 TSHR 2030/4885NPSR1 508/4885GRM2 190/4885

“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.