SCHEMBL31689573

SCHEMBL31689573

Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)OC(C)(C)C)cc1I

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 2/20 0.62
▸ HCRTR1 O43613 7/20 0.45
▸ HCRTR2 O43614 7/20 0.45
▸ FKBP1A P62942 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ MMP1 P03956 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP13 P45452 1/20 0.42

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
SCHEMBL6624711 0.85 CASP3 (0.63) CASP3HCRTR1HCRTR2FKBP1AKDM4E
SCHEMBL17323673 0.85 CASP3 (0.62) CASP3HCRTR1HCRTR2KDM4EALDH1A1
SCHEMBL16014995 0.80 CASP3 (0.62) CASP3HCRTR1HCRTR2FKBP1AKDM4E
SCHEMBL16014994 0.80 CASP3 (0.62) CASP3HCRTR1HCRTR2FKBP1AKDM4E
SCHEMBL16129184 0.80 CASP3 (0.62) CASP3HCRTR1HCRTR2FKBP1AKDM4E
SCHEMBL7086061 0.79 CASP3 (0.61) CASP3KDM4EALDH1A1MEN1POLB
SCHEMBL7086065 0.79 CASP3 (0.61) CASP3KDM4EALDH1A1MEN1POLB
SCHEMBL8248205 0.77 CASP3 (0.59) CASP3FKBP1AKDM4EALDH1A1MEN1
SCHEMBL6535374 0.77 CASP3 (1.00) CASP3
SCHEMBL6535370 0.77 CASP3 (1.00) CASP3

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-20250319046-A1 PHENYLALANINE-BASED LAT1 INHIBITORS AND USES THEREOF MAXYMUNE THERAPEUTICS INC (US) 2025-10-16 — — US disclosed
US-12427124-B1 Phenylalanine-based LAT1 inhibitors and uses thereof Maxymune Therapeutics, Inc. (US) 2025-09-30 — — 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 (2 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-12427124-B1 Phenylalanine-based LAT1 inhibitors and uses thereof SLC43A1, SLC7A1, SLC1A5 CASP3 4822/4885HCRTR1 3139/4885HCRTR2 2910/4885
US-20250319046-A1 PHENYLALANINE-BASED LAT1 INHIBITORS AND USES THEREOF SLC43A1, SLC7A1, SLC1A5 CASP3 4822/4885HCRTR1 3139/4885HCRTR2 2910/4885

“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.

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