SCHEMBL21797341

SCHEMBL21797341

CC(=O)NC1CCC(c2nncs2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.37
PDE7A Q13946 1/20 0.36
DRD2 P14416 2/20 0.35
HTR2A P28223 2/20 0.35
DRD3 P35462 2/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
POLB P06746 2/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
MAPK8 P45983 2/20 0.34
MAPK9 P45984 2/20 0.34
MAPK10 P53779 2/20 0.34

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
SCHEMBL21738137 1.00 SMN1; SMN2 (0.38) SMN1; SMN2HPGDPDE7ADRD2HTR2A
SCHEMBL21737987 1.00 SMN1; SMN2 (0.38) SMN1; SMN2HPGDPDE7ADRD2HTR2A
SCHEMBL21737884 0.91 ATM (0.38) SMN1; SMN2HPGDMTNR1AMTNR1BPOLB
SCHEMBL21737891 0.91 ATM (0.38) SMN1; SMN2HPGDMTNR1AMTNR1BPOLB
SCHEMBL21737882 0.88 ATM (0.39) SMN1; SMN2HPGDMTNR1AMTNR1BPOLB
SCHEMBL21080706 0.86 SMN1; SMN2 (0.39) SMN1; SMN2HPGDPOLBGAAKMT2A
SCHEMBL21080705 0.86 SMN1; SMN2 (0.39) SMN1; SMN2HPGDPOLBGAAKMT2A
SCHEMBL21737881 0.85 SMN1; SMN2 (0.41) SMN1; SMN2HPGDDRD2DRD3POLB
SCHEMBL21737888 0.85 LIPG (0.37) SMN1; SMN2HPGDDRD2HTR2APOLB
SCHEMBL21737983 0.85 LIPG (0.37) SMN1; SMN2HPGDDRD2HTR2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12060351-B2 Thiadiazole IRAK4 inhibitors GILEAD SCIENCES, INC. (US) 2024-08-13 US disclosed
CN-112566915-B Thiadiazole IRAK4 inhibitors 吉利德科学公司 2024-04-09 CN disclosed
US-11702414-B2 Thiadiazole IRAK4 inhibitors GILEAD SCIENCES, INC. (US) 2023-07-18 US disclosed
US-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS GILEAD SCIENCES, INC. 2022-12-22 US disclosed
US-20220098187-A1 THIADIAZOLE IRAK4 INHIBITORS GILEAD SCIENCES, INC. 2022-03-31 US disclosed
US-11046686-B2 Thiadiazole IRAK4 compounds GILEAD SCIENCES, INC. (US) 2021-06-29 US disclosed
CN-112566915-A Thiadiazole IRAK4 inhibitor 吉利德科学公司 2021-03-26 CN disclosed
US-20200079769-A1 THIADIAZOLE IRAK4 COMPOUNDS GILEAD SCIENCES, INC. 2020-03-12 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-11046686-B2 Thiadiazole IRAK4 compounds IRAK4, IRAK3, IRAK2 SMN1; SMN2 1175/4885HPGD 3081/4885PDE7A 1263/4885
US-20220098187-A1 THIADIAZOLE IRAK4 INHIBITORS IRAK4, IRAK3, IRAK1 SMN1; SMN2 1294/4885HPGD 2814/4885PDE7A 1218/4885
US-12060351-B2 Thiadiazole IRAK4 inhibitors IRAK4, IRAK3, IRAK1 SMN1; SMN2 1294/4885HPGD 2814/4885PDE7A 1218/4885
US-20200079769-A1 THIADIAZOLE IRAK4 COMPOUNDS IRAK4, IRAK3, IRAK2 SMN1; SMN2 1175/4885HPGD 3081/4885PDE7A 1263/4885
US-11702414-B2 Thiadiazole IRAK4 inhibitors IRAK4, IRAK3, IRAK1 SMN1; SMN2 1294/4885HPGD 2814/4885PDE7A 1218/4885
US-20220402910-A1 THIADIAZOLE IRAK4 INHIBITORS IRAK4, IRAK3, IRAK1 SMN1; SMN2 1294/4885HPGD 2814/4885PDE7A 1218/4885

“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.