SCHEMBL26324738

SCHEMBL26324738

CCOC(=O)C(=NS(=O)(=O)c1ccc(C)cc1)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.53
PRSS1 P07477 2/20 0.53
PRSS2 P07478 2/20 0.53
PRSS3 P35030 2/20 0.53
ALDH1A1 P00352 6/20 0.50
HTT P42858 2/20 0.50
HPGD P15428 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
POLB P06746 1/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
RECQL P46063 2/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
DHODH Q02127 1/20 0.45
LMNA P02545 2/20 0.43

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
SCHEMBL26324741 0.83 F2 (0.63) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL10728018 0.81 F2 (0.58) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL9611218 0.80 ALDH1A1 (0.59) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL26324736 0.79 F2 (0.51) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL26324734 0.79 F2 (0.51) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL20565357 0.78 KMT2A (0.44) ALDH1A1HTTCYP1A2CYP2C9POLB
SCHEMBL9858159 0.77 KMT2A (0.49) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL18214477 0.73 ALDH1A1 (0.59) ALDH1A1HTTCYP2C9KMT2AGAA
SCHEMBL15705594 0.73 LMNA (0.49) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL12871278 0.73 LMNA (0.49) F2PRSS1PRSS2PRSS3ALDH1A1

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.