SCHEMBL23536117

SCHEMBL23536117

CN(C)S(=O)(=O)c1ccc(S(=O)(=O)c2ccccc2N2CCC(c3ccc(Cl)cc3F)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
CNR1 P21554 4/20 0.40
GPR55 Q9Y2T6 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
HTT P42858 2/20 0.39
TP53 P04637 1/20 0.39
HTR6 P50406 1/20 0.38
THRB P10828 1/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
GRM2 Q14416 2/20 0.36
GRM5 P41594 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
SCHEMBL29931921 1.00 POLB (0.41) POLBCNR1GPR55SMN1; SMN2LMNA
SCHEMBL29931915 0.90 ALDH1A1 (0.39) SMN1; SMN2LMNAGAAHTTTP53
SCHEMBL29948574 0.89 POLB (0.42) POLBCNR1LMNAHTTHTR6
SCHEMBL23536112 0.89 POLB (0.42) POLBCNR1LMNAHTTHTR6
SCHEMBL29948492 0.88 SMN1; SMN2 (0.42) POLBCNR1GPR55SMN1; SMN2LMNA
SCHEMBL23535959 0.88 SMN1; SMN2 (0.42) POLBCNR1GPR55SMN1; SMN2LMNA
SCHEMBL23536124 0.84 TSHR (0.39) CNR1GPR55SMN1; SMN2LMNAGAA
SCHEMBL23535984 0.84 HTR1A (0.42) CNR1GPR55SMN1; SMN2LMNAGAA
SCHEMBL23536363 0.84 MCOLN2 (0.48) POLBSMN1; SMN2LMNAGAAHTT
SCHEMBL29931867 0.84 TSHR (0.39) CNR1GPR55SMN1; SMN2LMNAGAA

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 POLB 4797/4885CNR1 155/4885GPR55 145/4885

“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.