SCHEMBL25754876

SCHEMBL25754876

O=[N+]([O-])c1ccc(OC(F)(F)F)c(S(=O)(=O)Nc2c(Cl)cccc2Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 10/20 0.50
SLC22A12 Q96S37 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NHERF1 O14745 1/20 0.42
MCL1 Q07820 1/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HSD11B1 P28845 1/20 0.42
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL30199628 0.86 POLB (0.56) TBXA2RSMN1; SMN2POLBHPGDL3MBTL1
SCHEMBL23833774 0.86 POLB (0.56) TBXA2RSMN1; SMN2POLBHPGDL3MBTL1
SCHEMBL25759494 0.81 SLC22A12 (0.46) SLC22A12POLBL3MBTL1
SCHEMBL2646997 0.78 ALDH1A1 (0.42) TBXA2RSMN1; SMN2TDP1HSD11B1L3MBTL1
SCHEMBL23833770 0.78 AKR1C3 (0.41) TBXA2RSMN1; SMN2TDP1HSD11B1
SCHEMBL7686888 0.74 HSD17B10 (0.55) SMN1; SMN2HPGD
SCHEMBL25754683 0.72 POLB (0.57) TBXA2RSMN1; SMN2POLBTDP1HPGD
SCHEMBL25754734 0.71 POLB (0.55) TBXA2RSMN1; SMN2NHERF1MCL1POLB
SCHEMBL23833706 0.70 NHERF1 (0.49) TBXA2RSMN1; SMN2NHERF1MCL1TDP1
SCHEMBL23832708 0.70 SMN1; SMN2 (0.54) TBXA2RSMN1; SMN2POLBHPGDL3MBTL1

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-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-06-08 US disclosed
US-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-06-08 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-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF TRAP1, PINK1, TP53BP1 TBXA2R 3207/4885SLC22A12 3263/4885SMN1; SMN2 405/4885

“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.