SCHEMBL23263133

SCHEMBL23263133

COc1cncc(-c2cccc(=O)c(OC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 1/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.43
▸ MKNK2 Q9HBH9 1/20 0.43
▸ CYP11B1 P15538 6/20 0.41
▸ CYP11B2 P19099 6/20 0.41
▸ CYP1A2 P05177 4/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ BACE1 P56817 2/20 0.40
▸ BACE2 Q9Y5Z0 2/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KDR P35968 1/20 0.39
▸ SLC22A12 Q96S37 1/20 0.39
▸ CTSD P07339 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ TYRO3 Q06418 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ BRAF P15056 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
SCHEMBL23263168 0.86 BACE1 (0.38) ALOX5APMKNK1MKNK2CYP11B1CYP11B2
SCHEMBL23263201 0.85 BACE1 (0.39) MKNK1MKNK2BACE1KDR
SCHEMBL23263129 0.85 BACE1 (0.39) CYP11B1CYP11B2CYP1A2BACE1BACE2
SCHEMBL23263865 0.84 ABL1 (0.37) MKNK1MKNK2BACE1BACE2CTSD
SCHEMBL23263195 0.83 MKNK1 (0.46) MKNK1MKNK2CYP11B1CYP11B2
SCHEMBL23263914 0.82 FPR2 (0.43) MKNK1MKNK2PIK3CGFYN
SCHEMBL23263340 0.81 KIF11 (0.43) CYP11B1CYP11B2
SCHEMBL23259167 0.80 PARP1 (0.44) HDAC4HDAC8
SCHEMBL23263175 0.80 HSD17B1 (0.50) MKNK1MKNK2CYP1A2CYP3A4CYP2C9
SCHEMBL27018362 0.79 ELANE (0.35) ALOX5APCYP2C9CYP2C19FYN

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-20240018105-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS KINESID THERAPEUTICS, INC. (US) 2024-01-18 — — US disclosed
WO-2021076945-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Ambys Medicines, Inc. (US) 2021-04-22 — — 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-20240018105-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS TXNRD2, TXNRD1, SDHB ALOX5AP 1303/4885MKNK1 2259/4885MKNK2 2208/4885

“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.

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