SCHEMBL26328006

SCHEMBL26328006

C[SH](C)NCCC(O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC6A2 P23975 11/20 0.41
SLC6A4 P31645 11/20 0.41
SLC6A3 Q01959 11/20 0.41
CYP3A4 P08684 8/20 0.40
CYP2D6 P10635 8/20 0.40
KCNH2 Q12809 7/20 0.40
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.38
PLA2G1B P04054 1/20 0.38
POLB P06746 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38

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
SCHEMBL24303162 0.82 SLC6A4 (0.51) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL26328427 0.82 GAA (0.52) LMNASMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL26326729 0.78 ADRB2 (0.48) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL758732 0.78 SLC6A2 (0.49) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL11490664 0.76 SLC6A2 (0.46) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL26327813 0.76 MEN1 (0.51) LMNASLC6A4SLC6A3HTR1A
SCHEMBL12498803 0.75 HTT (0.47) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL11483225 0.75 SLC6A4 (0.49) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL31074202 0.74 HTR1A (0.44) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2
SCHEMBL3195289 0.74 HTR1A (0.44) ALDH1A1LMNAHTTSMN1; SMN2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767322-B2 Triazolopyridinyl compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-09-26 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-11767322-B2 Triazolopyridinyl compounds as kinase inhibitors RIPK1, RIPK3, RIPK4 ALDH1A1 4270/4885LMNA 3958/4885HTT 4384/4885

“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.