SCHEMBL10022970

SCHEMBL10022970

CC(c1ccc(COCC23COC(C)(OC2)OC3)cc1)c1ccc(COCC23COC(C)(OC2)OC3)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.33
▸ ESR1 P03372 1/20 0.32
▸ PDCD1 Q15116 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ CD274 Q9NZQ7 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
SCHEMBL10299206 0.88 PSMB1 (0.36) —
SCHEMBL5575731 0.81 TSHR (0.45) IDO1
SCHEMBL10022959 0.79 PSMB1 (0.40) —
SCHEMBL8750609 0.67 TSHR (0.56) IDO1ESR1PDCD1ESR2CD274
SCHEMBL14445085 0.66 TSHR (0.38) IDO1ESR1PDCD1ESR2CD274
SCHEMBL385146 0.65 EPHX1 (0.37) —
SCHEMBL22388405 0.65 IDO1 (0.44) IDO1
SCHEMBL31399378 0.64 — —
SCHEMBL12540784 0.64 TSHR (0.37) —
SCHEMBL9814589 0.64 PSMB1 (0.43) ESR1PDCD1ESR2CD274

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-8932797-B2 Photoacid generators DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 — — 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-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 (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-20120141939-A1 PHOTOACID GENERATORS F10, GNG2, H1-0 IDO1 3656/4885ESR1 1063/4885PDCD1 4855/4885
US-20120172555-A1 PHOTOACID GENERATING MONOMER AND PRECURSOR THEREOF SULT1A1, SULT1E1, SULT2A1 IDO1 1906/4885ESR1 389/4885PDCD1 4799/4885

“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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