SCHEMBL17356813

SCHEMBL17356813

COC(=O)CCCCCCC(=O)C1=C(C)C[C@H](C)OC1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.39
▸ ACP1 P24666 3/20 0.39
▸ CDC25B P30305 3/20 0.39
▸ HPSE Q9Y251 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ PTPN2 P17706 1/20 0.39
▸ DUSP3 P51452 1/20 0.39
▸ TSHR P16473 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PRKCA P17252 5/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ PTGER2 P43116 1/20 0.33

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
SCHEMBL17356820 0.79 PTPN1 (0.38) PTPN1ACP1CDC25BHPSETDP1
SCHEMBL3504085 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL3505206 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL494112 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL495079 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL81128 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL3501872 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL495288 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL3504568 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A
SCHEMBL494569 0.65 TSHR (0.82) RECQLTSHRLMNAALDH1A1KMT2A

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-9463188-B2 Osteopontin production inhibitor containing dictyopyrone derivative or dihydrodictyopyrone derivative as active ingredient TOHOKU UNIVERSITY (JP) 2016-10-11 — — US disclosed
US-9463188-B2 Osteopontin production inhibitor containing dictyopyrone derivative or dihydrodictyopyrone derivative as active ingredient TOHOKU UNIVERSITY (JP) 2016-10-11 — — US disclosed
US-20150366851-A1 OSTEOPONTIN PRODUCTION INHIBITOR CONTAINING DICTYOPYRONE DERIVATIVE OR DIHYDRODICTYOPYRONE DERIVATIVE AS ACTIVE INGREDIENT TOHOKU UNIVERSITY (JP) 2015-12-24 — — US disclosed
US-20150366851-A1 OSTEOPONTIN PRODUCTION INHIBITOR CONTAINING DICTYOPYRONE DERIVATIVE OR DIHYDRODICTYOPYRONE DERIVATIVE AS ACTIVE INGREDIENT TOHOKU UNIVERSITY (JP) 2015-12-24 — — 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-20150366851-A1 OSTEOPONTIN PRODUCTION INHIBITOR CONTAINING DICTYOPYRONE DERIVATIVE OR DIHYDRODICTYOPYRONE DERIVATIVE AS ACTIVE INGREDIENT SPPL2B, DPYSL3, DIAPH1 PTPN1 1624/4885ACP1 142/4885CDC25B 382/4885

“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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