SCHEMBL16154652

SCHEMBL16154652

Cn1nc(NS(C)(=O)=O)c2cccc(C(C)(C)C)c21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.41
PLA2G7 Q13093 1/20 0.36
KEAP1 Q14145 1/20 0.36
SSTR4 P31391 2/20 0.34
RORC P51449 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NR3C1 P04150 5/20 0.33
PGR P06401 5/20 0.33
NR3C2 P08235 5/20 0.33
AR P10275 5/20 0.33
MAT2A P31153 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
BRD4 O60885 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL19788938 0.88 CCR4 (0.40) CCR4SSTR4RORC
SCHEMBL24998323 0.86 CCR4 (0.39) CCR4SSTR4RORCNR3C2BRD4
SCHEMBL19788942 0.83 CCR4 (0.37) CCR4SSTR4RORCBRD4
SCHEMBL24998325 0.83 CCR4 (0.37) CCR4SSTR4BRD4
SCHEMBL20430021 0.81 CCR4 (0.40) CCR4KEAP1MAPTKMT2ANR3C1
SCHEMBL16006409 0.81 KEAP1 (0.42) CCR4KEAP1SSTR4MAPTKMT2A
SCHEMBL19788722 0.81 SSTR4 (0.35) CCR4SSTR4
SCHEMBL15995704 0.80 KEAP1 (0.41) CCR4KEAP1MAPTKMT2AMAT2A
SCHEMBL19788839 0.80 HTR1A (0.42) CCR4SSTR4BRD4
SCHEMBL19788939 0.80 CCR4 (0.39) CCR4SSTR4RORCBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312567-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-10-05 US disclosed
US-11680064-B2 Capsid inhibitors for the treatment of HIV GILEAD SCIENCES, INC. (US) 2023-06-20 US disclosed
US-20230038823-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2023-02-09 US disclosed
US-20210009555-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2021-01-14 US disclosed
US-9951043-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-04-24 US disclosed
US-9951043-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-04-24 US disclosed
US-9873680-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2018-01-23 US disclosed
US-20160108030-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-04-21 US disclosed
US-20140303164-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2014-10-09 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 (6 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-20230312567-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV HAVCR2, MAVS, CD4 CCR4 311/4885PLA2G7 1910/4885KEAP1 2594/4885
US-20210009555-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 CCR4 835/4885PLA2G7 1708/4885KEAP1 2233/4885
US-20230038823-A1 CAPSID INHIBITORS FOR THE TREATMENT OF HIV HAVCR2, MAVS, CD4 CCR4 311/4885PLA2G7 1910/4885KEAP1 2594/4885
US-20160108030-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 CCR4 835/4885PLA2G7 1708/4885KEAP1 2233/4885
US-20140303164-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, G6PD CCR4 895/4885PLA2G7 1657/4885KEAP1 2091/4885
US-11680064-B2 Capsid inhibitors for the treatment of HIV HAVCR2, MAVS, CD4 CCR4 311/4885PLA2G7 1910/4885KEAP1 2594/4885

“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.