SCHEMBL31689680

SCHEMBL31689680

CN(CCCOc1ccc2c(Cn3c(C(=O)O)cc4ccc(C(=N)NC(=O)OC(C)(C)C)cc43)cccc2c1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 7/20 0.34
▸ MTNR1A P48039 7/20 0.34
▸ MTNR1B P49286 7/20 0.34
▸ CCR9 P51686 2/20 0.34
▸ BCL2 P10415 2/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ LTB4R Q15722 1/20 0.33
▸ LTB4R2 Q9NPC1 1/20 0.33
▸ ACHE P22303 1/20 0.32

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
SCHEMBL21822377 1.00 MCL1 (0.34) MCL1MTNR1AMTNR1BCCR9BCL2
SCHEMBL25017969 0.94 MTNR1A (0.35) MCL1MTNR1AMTNR1BPDK2ACHE
SCHEMBL21822737 0.84 CTSS (0.42) MCL1CCR9
SCHEMBL31689662 0.84 CTSS (0.42) MCL1CCR9
SCHEMBL25017971 0.80 F10 (0.43) MCL1BCL2
SCHEMBL21822112 0.80 NQO2 (0.37) MCL1CCR9
SCHEMBL31689687 0.80 NQO2 (0.37) MCL1CCR9
SCHEMBL21822553 0.79 NQO2 (0.44) MTNR1AMTNR1B
SCHEMBL21822575 0.75 F10 (0.42) MCL1MTNR1AMTNR1BBCL2
SCHEMBL31689703 0.75 F10 (0.42) MCL1MTNR1AMTNR1BBCL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12428415-B2 Matriptase 2 inhibitors and uses thereof DISC MEDICINE, INC. (US) 2025-09-30 — — 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 (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-12428415-B2 Matriptase 2 inhibitors and uses thereof MMP7, MATR3, SPINT2 MCL1 3593/4885MTNR1A 1514/4885MTNR1B 1068/4885

“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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