SCHEMBL2008463

SCHEMBL2008463

c1cc2c(s1)-c1sccc1C21OCCO1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.30
▸ CES1 P23141 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL12900243 0.74 — —
SCHEMBL19356150 0.67 TAAR1 (0.31) —
SCHEMBL22807704 0.65 CES1 (0.35) CES1
SCHEMBL9927227 0.65 ESR1 (0.33) CES1ALDH1A1
SCHEMBL10038366 0.63 — —
SCHEMBL21709994 0.62 ALDH1A1 (0.40) ALDH1A1KMT2A
SCHEMBL16532992 0.62 USP8 (0.49) ALDH1A1KMT2A
SCHEMBL15763741 0.61 NOTUM (0.33) —
SCHEMBL12567043 0.61 KMT2A (0.35) KMT2A
SCHEMBL20991161 0.60 NOS3 (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158275-B2 Fluorine-containing compound and method for producing same, fluorine-containing polymer, organic thin film, and organic thin film device OSAKA UNIVERSITY (JP) 2012-04-17 — — US disclosed
US-8158275-B2 Fluorine-containing compound and method for producing same, fluorine-containing polymer, organic thin film, and organic thin film device OSAKA UNIVERSITY (JP) 2012-04-17 — — US disclosed
US-7964650-B2 Carbonyl-functionalized thiophene compounds and related device structures NORTHWESTERN UNIVERSITY (US) 2011-06-21 — — US disclosed
EP-2240528-A1 SEMICONDUCTOR MATERIALS PREPARED FROM RYLENE-( -ACCEPTOR) COPOLYMERS BASF SE (DE) 2010-10-20 — — EP disclosed
US-20090267061-A1 Carbonyl-Functionalized Thiophene Compounds and Related Device Structures POLYERA CORPORATION 2009-10-29 — — US disclosed
US-20090240014-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-24 — — US disclosed
US-20090240014-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-24 — — US disclosed
WO-2009098254-A1 SEMICONDUCTOR MATERIALS PREPARED FROM RYLENE-(π-ACCEPTOR) COPOLYMERS BASF SE (DE) 2009-08-13 — — WO disclosed
US-7528176-B2 organic field effect transistor device comprising semiconductor component (comprises a composition of thiophene-carbonyl compounds and polymer); enhanced solubility in a solvent and thermal stablity; promote electron and hole mobilities; in thermal analysis, molecular spectroscopy, electrochemistry NORTHWESTERN UNIVERSITY (US) 2009-05-05 — — US disclosed
EP-1997821-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE Osaka University (JP) 2008-12-03 — — EP disclosed
EP-1831205-A1 CARBONYL-FUNCTIONALIZED THIOPHENE COMPOUNDS AND RELATED DEVICE STRUCTURES Northwestern University (US) 2007-09-12 — — EP disclosed
WO-2007050049-A1 CARBONYL-FUNCTIONALIZED THIOPHENE COMPOUNDS AND RELATED DEVICE STRUCTURES NORTHWESTERN UNIVERSITY (US) 2007-05-03 — — WO disclosed
US-20060186401-A1 Carbonyl-functionalized thiophene compounds and related device structures POLYERA CORPORATION 2006-08-24 — — 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 (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-20090267061-A1 Carbonyl-Functionalized Thiophene Compounds and Related Device Structures TEC, OR10J3, TRPA1 SIGMAR1 1237/4885CES1 4790/4885ALDH1A1 1386/4885
US-20090240014-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE AFF1, AFF2, RFT1 SIGMAR1 1450/4885CES1 2796/4885ALDH1A1 849/4885

“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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