SCHEMBL4547548

SCHEMBL4547548

CCOC(=O)/C(=C\C=C\N(CC)CC)S(=O)(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.45
▸ LMNA P02545 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KMT2A Q03164 7/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL13609924 1.00 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14456207 1.00 ALDH1A1 (0.45) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL10972015 0.92 ALDH1A1 (0.41) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL13879916 0.90 POLB (0.38) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL21128717 0.89 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL18415027 0.89 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL12864658 0.89 ALDH1A1 (0.46) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL22453309 0.89 ALDH1A1 (0.43) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14354774 0.88 ALDH1A1 (0.42) ALDH1A1LMNAGAAHPGDSMN1; SMN2
SCHEMBL14097777 0.88 KDM4E (0.40) ALDH1A1LMNAGAAHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9543521-B2 Organic semiconductor device and process for its production BASF SE (DE) 2017-01-10 — — US disclosed
US-9543521-B2 Organic semiconductor device and process for its production BASF SE (DE) 2017-01-10 — — US disclosed
US-20140306212-A1 ORGANIC SEMICONDUCTOR DEVICE AND PROCESS FOR ITS PRODUCTION BASF SE (DE) 2014-10-16 — — US disclosed
US-20140306212-A1 ORGANIC SEMICONDUCTOR DEVICE AND PROCESS FOR ITS PRODUCTION BASF SE (DE) 2014-10-16 — — US disclosed
US-20130306151-A1 ORGANIC PHOTOVOLTAIC DEVICE AND MANUFACTURING METHOD THEREOF BASF SE (DE) 2013-11-21 — — US disclosed
US-20130251650-A1 MIXTURES COMPRISING BENZOTRIAZOLES AND MEROCYANINES BASF SE (DE) 2013-09-26 — — US disclosed
US-20130251650-A1 MIXTURES COMPRISING BENZOTRIAZOLES AND MEROCYANINES BASF SE (DE) 2013-09-26 — — US disclosed
US-8454940-B2 Mixtures comprising benzotriazoles and merocyanines BASF SE (DE) 2013-06-04 — — US disclosed
US-8454940-B2 Mixtures comprising benzotriazoles and merocyanines BASF SE (DE) 2013-06-04 — — US disclosed
US-8368858-B2 Optical film, polarizing plate, and VA-mode liquid crystal display device FUJIFILM CORPORATION (JP) 2013-02-05 — — US disclosed
WO-2012095796-A1 ORGANIC PHOTOVOLTAIC DEVICE AND MANUFACTURING METHOD THEREOF BASF SE (DE) 2012-07-19 — — WO disclosed
US-20120140161-A1 POLYMER FILM, RETARDATION FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY DEVICE AND ULTRAVIOLET ABSORBER FUJIFILM CORPORATION (JP) 2012-06-07 — — US disclosed
US-8178601-B2 Polymer film, polarizing plate protective film, polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-05-15 — — US disclosed
US-20110200540-A1 MIXTURES COMPRISING BENZOTRIAZOLES AND MEROCYANINES BASF SE (DE) 2011-08-18 — — US disclosed
US-20110200540-A1 MIXTURES COMPRISING BENZOTRIAZOLES AND MEROCYANINES BASF SE (DE) 2011-08-18 — — US disclosed
US-20090080074-A1 POLYMER FILM, POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2009-03-26 — — US disclosed
US-20080204644-A1 Liquid crystal display device FUJIFILM CORPORATION (JP) 2008-08-28 — — US disclosed
US-20080192192-A1 Optical film and polarizing plate FUJIFILM CORPORATION (JP) 2008-08-14 — — US disclosed
EP-1936431-A2 Liquid crystal display device FUJIFILM Corporation (JP) 2008-06-25 — — EP 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-20090080074-A1 POLYMER FILM, POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE RPA3, RTF1, RPA1 ALDH1A1 3470/4885LMNA 1780/4885GAA 4850/4885
US-20110200540-A1 MIXTURES COMPRISING BENZOTRIAZOLES AND MEROCYANINES CRYZ, CRY1, ARNT ALDH1A1 691/4885LMNA 2255/4885GAA 2186/4885

“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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