SCHEMBL10022959

SCHEMBL10022959

CC(c1ccc(OCC23COC(C)(OC2)OC3)cc1)c1ccc(OCC23COC(C)(OC2)OC3)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PSMB1 P20618 1/20 0.40
▸ PSMB5 P28074 1/20 0.40
▸ ACACB O00763 3/20 0.34
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ FKBP1A P62942 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL9814589 0.82 PSMB1 (0.43) PSMB1PSMB5ACACBMEN1KMT2A
SCHEMBL10299206 0.80 PSMB1 (0.36) PSMB1PSMB5ACACBKMT2AALDH1A1
SCHEMBL10022970 0.79 IDO1 (0.33) —
SCHEMBL12855824 0.74 ABCB11 (0.33) —
SCHEMBL12855817 0.74 ESR1 (0.31) ACACBALDH1A1
SCHEMBL13498028 0.67 KMT2A (0.41) MEN1KMT2AFKBP1A
SCHEMBL26806297 0.66 ACACB (0.47) ACACBCYP1A2CYP3A4GAACYP2C9
SCHEMBL12203937 0.66 NQO1 (0.67) PSMB1PSMB5ACACBALDH1A1
SCHEMBL4461068 0.64 DRD2 (0.40) CYP1A2CYP3A4GAACYP2C9CYP2C19
SCHEMBL2836200 0.64 ALDH1A1 (0.36) ACACBCYP1A2CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8932797-B2 Photoacid generators DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 — — US disclosed
US-8907122-B2 Method of preparing photoacid generating monomer ROHM AND HAAS ELECTRONIC MATERIAL LLC (US) 2014-12-09 — — US disclosed
US-8716518-B2 Photoacid generating monomer and precursor thereof ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2014-05-06 — — US disclosed
US-20120172555-A1 PHOTOACID GENERATING MONOMER AND PRECURSOR THEREOF DOW GLOBAL TECHNOLOGIES LLC 2012-07-05 — — US disclosed
US-20120172619-A1 METHOD OF PREPARING PHOTOACID GENERATING MONOMER ROHM AND HAAS ELECTRONIC MATERIALS LLC 2012-07-05 — — US disclosed
US-20120141939-A1 PHOTOACID GENERATORS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2012-06-07 — — 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 (3 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-20120141939-A1 PHOTOACID GENERATORS F10, GNG2, H1-0 PSMB1 1568/4885PSMB5 1905/4885ACACB 2715/4885
US-20120172555-A1 PHOTOACID GENERATING MONOMER AND PRECURSOR THEREOF SULT1A1, SULT1E1, SULT2A1 PSMB1 2168/4885PSMB5 1919/4885ACACB 4142/4885
US-20120172619-A1 METHOD OF PREPARING PHOTOACID GENERATING MONOMER POLL, SULT1A1, SULT1E1 PSMB1 2189/4885PSMB5 2588/4885ACACB 3411/4885

“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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