SCHEMBL26324741

SCHEMBL26324741

COC(=O)C(=NS(=O)(=O)c1ccc(C)cc1)C(=O)OC

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 11/20 0.63
PRSS1 P07477 11/20 0.63
PRSS2 P07478 11/20 0.63
PRSS3 P35030 11/20 0.63
HTT P42858 1/20 0.53
ALDH1A1 P00352 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL26324738 0.83 F2 (0.53) F2PRSS1PRSS2PRSS3HTT
SCHEMBL26324734 0.82 F2 (0.51) F2PRSS1PRSS2PRSS3HTT
SCHEMBL26324736 0.82 F2 (0.51) F2PRSS1PRSS2PRSS3HTT
SCHEMBL20447060 0.80 F2 (0.55) F2PRSS1PRSS2PRSS3HTT
SCHEMBL20447036 0.80 F2 (0.55) F2PRSS1PRSS2PRSS3HTT
SCHEMBL20447034 0.80 F2 (0.55) F2PRSS1PRSS2PRSS3HTT
SCHEMBL26324757 0.77 F2 (0.44) F2PRSS1PRSS2PRSS3HTT
SCHEMBL22699663 0.74 F2 (0.68) F2PRSS1PRSS2PRSS3HTT
SCHEMBL22634996 0.73 F2 (0.61) F2PRSS1PRSS2PRSS3HTT
SCHEMBL22634995 0.73 F2 (0.61) F2PRSS1PRSS2PRSS3HTT

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-11767291-B2 Preparation of secondary amines with electrophilic N-linchpin reagents WILLIAM MARSH RICE UNIVERSITY (US) 2023-09-26 US disclosed
US-11767291-B2 Preparation of secondary amines with electrophilic N-linchpin reagents WILLIAM MARSH RICE UNIVERSITY (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-11767291-B2 Preparation of secondary amines with electrophilic N-linchpin reagents PNMT, NCL, NPM1 F2 3231/4885PRSS1 4869/4885PRSS2 4452/4885

“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.