SCHEMBL21603808

SCHEMBL21603808

COc1ccc(NC(=O)NC2CCc3sc(NC(=O)C4CC4)cc3C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
EPHX1 P07099 1/20 0.50
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
MTNR1A P48039 3/20 0.44
MTNR1B P49286 3/20 0.44
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.41

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
SCHEMBL21597854 0.79 TP53 (0.41) NPC1RAB9AKMT2AMEN1MTNR1A
SCHEMBL21603867 0.77 TP53 (0.39) EPHX2NPC1RAB9AMTNR1AMTNR1B
SCHEMBL28624417 0.77 KMT2A (0.40) RAB9AKMT2AMEN1MTNR1AMTNR1B
SCHEMBL21603645 0.76 EPHX2 (0.46) EPHX2NPC1RAB9AEPHX1MTNR1A
SCHEMBL21597559 0.76 EPHX2 (0.45) EPHX2NPC1RAB9AEPHX1KMT2A
SCHEMBL28609236 0.75 TP53 (0.36) NPC1RAB9AMTNR1AMTNR1B
SCHEMBL28622749 0.75 TP53 (0.36) NPC1RAB9AMTNR1AMTNR1B
SCHEMBL21603763 0.73 TP53 (0.39) NPC1RAB9AKMT2AMEN1HPGD
SCHEMBL21603764 0.72 ALDH1A1 (0.54) NPC1RAB9AKMT2AMEN1
SCHEMBL21597427 0.72 TBXAS1 (0.46) NPC1RAB9AKMT2AMEN1HPGD

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 3 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 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 (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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE TSLP, CYSLTR1, CYSLTR2 EPHX2 1603/4885NPC1 185/4885RAB9A 2032/4885

“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.