SCHEMBL14280445

SCHEMBL14280445

c1cc(N(CC2CC2)CC2CO2)ccc1Cc1ccc(N(CC2CO2)CC2CO2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MGLL Q99685 2/20 0.33
S1PR1 P21453 1/20 0.33
AR P10275 1/20 0.33
LMNA P02545 3/20 0.33
CHRM2 P08172 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL22872217 1.00 ALDH1A1 (0.34) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL16622154 1.00 ALDH1A1 (0.34) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL142324 0.91 ALDH1A1 (0.40) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL15195722 0.91 ALDH1A1 (0.40) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL19828106 0.91 ALDH1A1 (0.40) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL15856896 0.91 ALDH1A1 (0.40) ALDH1A1CYP3A4TSHRMAPK1TDP1
Hydrochloric Acid SCHEMBL31254397 0.88 ALDH1A1 (0.38) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL23287956 0.88 ALDH1A1 (0.43) ALDH1A1CYP3A4TSHRMAPK1TDP1
SCHEMBL18902677 0.87
SCHEMBL22872216 0.86 NSD2 (0.33) ALDH1A1CYP3A4TSHRMAPK1TDP1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11731932-B2 Silicon-containing compositions and their methods of use ADITYA BIRLA CHEMICALS (USA), INC. (US) 2023-08-22 US disclosed
US-9947480-B2 Electrolyte material formulation, electrolyte material composition formed therefrom and use thereof ETERNAL MATERIALS CO., LTD. (TW) 2018-04-17 US disclosed
US-20170298198-A1 AROMATIC POLYAMIDE FILMS FOR SOLVENT RESISTANT FLEXIBLE SUBSTRATES SUMITOMO BAKELITE CO., LTD. (JP) 2017-10-19 US disclosed
US-9691551-B2 Electrolyte material formulation, electrolyte material composition formed therefrom and use thereof ETERNAL MATERIALS CO., LTD. (TW) 2017-06-27 US disclosed
US-20160240321-A1 ELECTROLYTE MATERIAL FORMULATION, ELECTROLYTE MATERIAL COMPOSITION FORMED THEREFROM AND USE THEREOF ETERNAL MATERIALS CO., LTD. (TW) 2016-08-18 US disclosed
US-9376560-B2 Matrix material HONDA MOTOR CO., LTD. (JP) 2016-06-28 US disclosed
US-9039951-B2 Curable resin composition and short-cure method CYTEC TECHNOLOGY CORP. (US) 2015-05-26 US disclosed
US-9040225-B2 Developable bottom antireflective coating composition and pattern forming method using thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-05-26 US disclosed
US-20150050601-A1 DEVELOPABLE BOTTOM ANTIREFLECTIVE COATING COMPOSITION AND PATTERN FORMING METHOD USING THEREOF GLOBALFOUNDRIES U.S. INC. 2015-02-19 US disclosed
US-20150005458-A1 MATRIX MATERIAL HONDA MOTOR CO., LTD. (JP) 2015-01-01 US disclosed
US-20140175683-A1 AROMATIC POLYAMIDE FILMS FOR SOLVENT RESISTANT FLEXIBLE SUBSTRATES AKRON POLYMER SYSTEMS, INC. (US) 2014-06-26 US disclosed
US-20140154479-A1 RESIN COMPOSITION FOR PRINTED CIRCUIT BOARD, INSULATING FILM, PREPREG AND PRINTED CIRCUIT BOARD SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) 2014-06-05 US disclosed
US-20140076198-A1 EPOXY RESIN COMPOSITION FOR INSULATION, INSULATING FILM, PREPREG, AND PRINTED CIRCUIT BOARD SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) 2014-03-20 US disclosed
US-20140072915-A1 PHOTORESIST COMPOSITION CONTAINING A PROTECTED HYDROXYL GROUP FOR NEGATIVE DEVELOPMENT AND PATTERN FORMING METHOD USING THEREOF INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-03-13 US disclosed
US-20130288178-A1 PHOTORESIST COMPOSITION CONTAINING A PROTECTED HYDROXYL GROUP FOR NEGATIVE DEVELOPMENT AND PATTERN FORMING METHOD USING THEREOF INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-10-31 US disclosed
US-20130170103-A1 ELECTROLYTE MATERIAL FORMULATION, ELECTROLYTE MATERIAL COMPOSITION FORMED THEREFROM AND USE THEREOF Gemmy Electronic Co., Ltd. (TW) 2013-07-04 US disclosed
US-20130157463-A1 NEAR-INFRARED ABSORBING FILM COMPOSITION FOR LITHOGRAPHIC APPLICATION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-06-20 US disclosed
US-20130010403-A1 ELECTROLYTIC MATERIAL FORMULATION, ELECTROLYTIC MATERIAL COMPOSITION FORMED THEREFROM AND USE THEREOF Gemmy Electronic Co., Ltd. 2013-01-10 US disclosed
US-7323289-B2 Bottom anti-reflective coatings derived from small core molecules with multiple epoxy moieties BREWER SCIENCE INC. (US) 2008-01-29 US disclosed
US-20070092776-A1 Sulfonic acid group-containing organic-silica composite membrane and method for producing thereof EBARA CORPORATION (JP) 2007-04-26 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-11731932-B2 Silicon-containing compositions and their methods of use SRM, REV1, RER1 ALDH1A1 3388/4885CYP3A4 4618/4885TSHR 4735/4885

“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.