SCHEMBL25264993

SCHEMBL25264993

C=CCC(N[S@+]([O-])C(C)(C)C)c1ccc(F)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL25189956 1.00 SMN1; SMN2 (0.34) SMN1; SMN2ATML3MBTL1ALDH1A1CYP1A2
SCHEMBL25264994 1.00 SMN1; SMN2 (0.34) SMN1; SMN2ATML3MBTL1ALDH1A1CYP1A2
SCHEMBL30360115 1.00 SMN1; SMN2 (0.34) SMN1; SMN2ATML3MBTL1ALDH1A1CYP1A2
SCHEMBL31316767 0.87 SMN1; SMN2 (0.35) SMN1; SMN2ATML3MBTL1ALDH1A1CYP1A2
SCHEMBL19578925 0.87 SMN1; SMN2 (0.35) SMN1; SMN2ATML3MBTL1ALDH1A1CYP1A2
SCHEMBL2862463 0.86 EEF2K (0.37) SMN1; SMN2ATML3MBTL1
SCHEMBL25265290 0.86
SCHEMBL30360143 0.86
SCHEMBL25188781 0.86
SCHEMBL25265291 0.86

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-20250154173-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-05-15 US disclosed
WO-2025096697-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-05-08 WO disclosed
US-12180226-B2 Spirotricycle RIPK1 inhibitors and methods of uses thereof MERCK SHARP & DOHME LLC (US) 2024-12-31 US disclosed
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-25 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 (3 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-12180226-B2 Spirotricycle RIPK1 inhibitors and methods of uses thereof RIPK1, RIPK3, RIPK4 SMN1; SMN2 4062/4885ATM 1642/4885L3MBTL1 2859/4885
US-20230159558-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF RIPK1, RIPK3, RIPK4 SMN1; SMN2 4062/4885ATM 1642/4885L3MBTL1 2859/4885
US-20250154173-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 SMN1; SMN2 1667/4885ATM 1207/4885L3MBTL1 1887/4885

“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.