SCHEMBL25033937

SCHEMBL25033937

CC(C)(C)OC(=O)CCCOc1ccc(-c2ccc(OCc3ccccc3)nc2OCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 3/20 0.40
▸ HDAC8 Q9BY41 1/20 0.39
▸ GSTP1 P09211 1/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ PTPN1 P18031 2/20 0.38
▸ NR1H2 P55055 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TRPV3 Q8NET8 1/20 0.37
▸ MCL1 Q07820 2/20 0.37
▸ BAK1 Q16611 1/20 0.37

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
SCHEMBL25819122 0.90 HDAC8 (0.41) FFAR4HDAC8GSTP1LTA4HCNR1
SCHEMBL25821509 0.90 FFAR4 (0.43) FFAR4HDAC8NR1H2MCL1BAK1
SCHEMBL27411319 0.89 PTPN1 (0.47) GSTP1CNR1PTPN1NPC1MCL1
SCHEMBL28969675 0.87 FFAR4 (0.51) FFAR4GSTP1
SCHEMBL30817313 0.85 CA12 (0.48) PTPN1NPC1HTTRAB9ASMN1; SMN2
SCHEMBL26641260 0.85 FFAR4 (0.39) FFAR4HDAC8NR1H2MCL1BAK1
SCHEMBL30475485 0.84 TRPV3 (0.37) TRPV3MCL1BAK1
SCHEMBL25033869 0.84 TRPV3 (0.37) TRPV3MCL1BAK1
SCHEMBL31152762 0.84 L3MBTL1 (0.45) LTA4HCNR1NPC1HTTRAB9A
SCHEMBL28969658 0.83 LTB4R (0.47) FFAR4HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 — — US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 — — US disclosed
WO-2023018238-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 — — WO disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 — — 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-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND PLK1, BUB1B, BUB1 FFAR4 4754/4885HDAC8 731/4885GSTP1 1916/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 FFAR4 4733/4885HDAC8 863/4885GSTP1 1394/4885

“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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