SCHEMBL25819122

SCHEMBL25819122

Cc1ccc(-c2ccc(OCCCC(=O)OC(C)(C)C)cc2)c(OCc2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.41
▸ FFAR4 Q5NUL3 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ LTA4H P09960 3/20 0.39
▸ GBA1 P04062 1/20 0.39
▸ PTPN1 P18031 2/20 0.39
▸ GSTP1 P09211 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CYSLTR2 Q9NS75 1/20 0.38
▸ CYSLTR1 Q9Y271 1/20 0.38
▸ NR1H2 P55055 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
SCHEMBL25033937 0.90 FFAR4 (0.40) HDAC8FFAR4NPC1CNR1HTT
SCHEMBL25819108 0.90 FFAR4 (0.43) HDAC8FFAR4CYSLTR2CYSLTR1
SCHEMBL25819525 0.83 CCNT1 (0.34) HDAC8CNR1GBA1PTPN1
SCHEMBL25821509 0.80 FFAR4 (0.43) HDAC8FFAR4NR1H2
SCHEMBL27411319 0.79 PTPN1 (0.47) NPC1CNR1PTPN1GSTP1KDM4E
SCHEMBL26043795 0.77 YAP1 (0.40) FFAR4CNR1
SCHEMBL28969675 0.76 FFAR4 (0.51) FFAR4GSTP1CYSLTR2CYSLTR1
SCHEMBL25819126 0.76 L3MBTL1 (0.47) CNR1HTTLMNA
SCHEMBL30817313 0.76 CA12 (0.48) NPC1HTTRAB9ASMN1; SMN2PTPN1
SCHEMBL26641260 0.75 FFAR4 (0.39) HDAC8FFAR4NR1H2

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-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

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 HDAC8 731/4885FFAR4 4754/4885NPC1 2366/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 HDAC8 863/4885FFAR4 4733/4885NPC1 2960/4885

“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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