SCHEMBL22901899

SCHEMBL22901899

CC(C)NC(=O)c1cnc[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.53
TP53 P04637 3/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
ACACB O00763 1/20 0.51
KMT2A Q03164 3/20 0.49
ELANE P08246 1/20 0.45
CYP17A1 P05093 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
GAA P10253 1/20 0.42
XDH P47989 2/20 0.41
MEN1 O00255 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
JAK3 P52333 1/20 0.40

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
SCHEMBL31688156 0.82 TP53 (0.49) SMN1; SMN2TP53NPC1RAB9AACACB
SCHEMBL18912254 0.79 ACACB (0.45) SMN1; SMN2TP53NPC1RAB9AACACB
SCHEMBL6662772 0.79
SCHEMBL18912366 0.78 ACACB (0.52) SMN1; SMN2TP53NPC1RAB9AACACB
SCHEMBL18912252 0.77 TP53 (0.48) SMN1; SMN2TP53NPC1RAB9AACACB
SCHEMBL21084204 0.76
SCHEMBL18912207 0.76 ACR (0.48) SMN1; SMN2TP53NPC1RAB9AACACB
SCHEMBL21268151 0.75
SCHEMBL6662834 0.75 TP53 (0.43) SMN1; SMN2TP53NPC1RAB9AKMT2A
SCHEMBL2827683 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US disclosed
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US disclosed
US-11213592-B2 Antibody-sting agonist conjugates and their use in immunotherapy IMMUNESENSOR THERAPEUTICS, INC. (US) 2022-01-04 US disclosed
US-20210290774-A1 ANTIBODY-STING AGONIST CONJUGATES AND THEIR USE IN IMMUNOTHERAPY IMMUNESENSOR THERAPEUTICS, INC. (US) 2021-09-23 US disclosed
US-11033635-B2 Antibody-STING agonist conjugates and their use in immunotherapy IMMUNESENSOR THERAPEUTICS, INC. (US) 2021-06-15 US disclosed
US-20210015941-A1 ANTIBODY-STING AGONIST CONJUGATES AND THEIR USE IN IMMUNOTHERAPY IMMUNESENSOR THERAPEUTICS, INC. (US) 2021-01-21 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 (5 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-11213592-B2 Antibody-sting agonist conjugates and their use in immunotherapy STING1, CGAS, MAVS SMN1; SMN2 3384/4885TP53 619/4885NPC1 1431/4885
US-20210290774-A1 ANTIBODY-STING AGONIST CONJUGATES AND THEIR USE IN IMMUNOTHERAPY STING1, CGAS, MAVS SMN1; SMN2 3384/4885TP53 619/4885NPC1 1431/4885
US-11033635-B2 Antibody-STING agonist conjugates and their use in immunotherapy STING1, CGAS, MAVS SMN1; SMN2 3384/4885TP53 619/4885NPC1 1431/4885
US-20210015941-A1 ANTIBODY-STING AGONIST CONJUGATES AND THEIR USE IN IMMUNOTHERAPY STING1, CGAS, MAVS SMN1; SMN2 3384/4885TP53 619/4885NPC1 1431/4885
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV SMN1; SMN2 3613/4885TP53 524/4885NPC1 481/4885

“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.