SCHEMBL21557567

SCHEMBL21557567

O=C(O)C1COc2cc(-c3ccccn3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 8/20 0.40
LTB4R2 Q9NPC1 2/20 0.40
ABL1 P00519 1/20 0.40
DHODH Q02127 1/20 0.40
KAT6A Q92794 1/20 0.39
ACVR1B P36896 1/20 0.39
TGFBR1 P36897 1/20 0.39
FFAR1 O14842 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
CNR1 P21554 1/20 0.38

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
SCHEMBL21557568 0.86 ABL1 (0.42) LTB4RABL1CNR1
SCHEMBL21557499 0.75 MAP4K4 (0.50) ABL1DHODHKAT6A
SCHEMBL21557666 0.75 CYP4F2 (0.47) ABL1DHODH
SCHEMBL21557622 0.73 F2 (0.47) ABL1DHODHKAT6A
SCHEMBL23362454 0.72 GSK3B (0.39) LTB4RABL1KAT6AACVR1BTGFBR1
SCHEMBL2794624 0.72 GLS (0.47) LTB4RLTB4R2
SCHEMBL28073801 0.71 CYP3A4 (0.44) FFAR1
SCHEMBL21557486 0.71 FFAR1 (0.47) ABL1DHODHFFAR1
SCHEMBL31704184 0.70 FFAR1 (0.41) LTB4RLTB4R2FFAR1PPARGPPARD
SCHEMBL21451444 0.68 NPC1 (0.56) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647710-B2 Thiazole derivative and applications thereof MEDSHINE DISCOVERY INC. (CN) 2020-05-12 US disclosed
EP-3566749-A1 THIAZOLE DERIVATIVE AND APPLICATIONS THEREOF Medshine Discovery Inc. (CN) 2019-11-13 EP 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-10647710-B2 Thiazole derivative and applications thereof TSLP, TK2, TK1 LTB4R 1421/4885LTB4R2 1311/4885ABL1 881/4885

“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.