SCHEMBL21597586

SCHEMBL21597586

CONC(=NC#N)NC1CCc2sc(NC(=O)C3CC3)c(C(=O)NCC3CC3)c2C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.43
CNR1 P21554 5/20 0.43
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPT P10636 1/20 0.40
FLT3 P36888 1/20 0.37
REV1 Q9UBZ9 2/20 0.37
ALDH1A1 P00352 3/20 0.36
GAA P10253 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL21597793 0.90 CNR2 (0.41) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597090 0.90 CNR2 (0.41) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597157 0.87 CNR2 (0.42) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597068 0.86 CNR2 (0.39) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597149 0.85 CNR2 (0.46) CNR2CNR1KDM4EMAPTALDH1A1
SCHEMBL21597054 0.85 MAPT (0.41) CNR2CNR1KDM4EMAPTALDH1A1
SCHEMBL27418305 0.85 CNR2 (0.46) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL28611889 0.83 CNR2 (0.37) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597123 0.82 CNR2 (0.48) CNR2CNR1KDM4EHSD17B10MAPT
SCHEMBL21597395 0.82 FLT3 (0.45) CNR2CNR1KDM4EHSD17B10MAPT

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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2024-06-25 US claimed
US-20220332709-A1 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2022-10-20 US claimed
CN-112566910-A Thiophene derivatives for the treatment of IgE induced diseases UCB生物制药有限责任公司 2021-03-26 CN claimed
US-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2024-06-25 US disclosed
US-20220332709-A1 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2022-10-20 US disclosed
EP-3810606-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2021-04-28 EP disclosed
CN-112566910-A Thiophene derivatives for the treatment of IgE induced diseases UCB生物制药有限责任公司 2021-03-26 CN disclosed
WO-2019243550-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2019-12-26 WO 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 (2 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-20220332709-A1 Thiophene derivatives for the treatment of disorders caused by IgE TSLP, CYSLTR1, CYSLTR2 CNR2 1326/4885CNR1 823/4885KDM4E 3965/4885
US-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE TSLP, CYSLTR1, CYSLTR2 CNR2 1326/4885CNR1 823/4885KDM4E 3965/4885

“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.