SCHEMBL560890

SCHEMBL560890

C=CCN(CC=C)CCOCCO

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 8/20 0.42
MEN1 O00255 5/20 0.42
KDM4E B2RXH2 10/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 8/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
HPGD P15428 1/20 0.35
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
HSD17B10 Q99714 1/20 0.34
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 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
SCHEMBL561136 0.89 KMT2A (0.48) KMT2AMEN1KDM4ESMN1; SMN2POLB
SCHEMBL17807213 0.88 TSHR (0.40) TSHRMAPK1KMT2AMEN1KDM4E
SCHEMBL17807214 0.86 KMT2A (0.42) TSHRMAPK1KMT2AMEN1KDM4E
SCHEMBL16810625 0.78 KMT2A (0.50) KMT2AMEN1KDM4ESMN1; SMN2POLB
SCHEMBL1463983 0.78 TSHR (0.62) TSHRMAPK1KMT2AMEN1POLB
SCHEMBL16800253 0.76 KMT2A (0.44) KMT2AMEN1KDM4ESMN1; SMN2POLB
SCHEMBL12907797 0.76 MEN1 (0.65) TSHRMAPK1KMT2AMEN1POLB
SCHEMBL30359262 0.76 TSHR (0.59) TSHRMAPK1KMT2AMEN1POLB
SCHEMBL63684 0.76 MEN1 (0.65) TSHRMAPK1KMT2AMEN1POLB
SCHEMBL147493 0.76 TSHR (0.37) TSHRKMT2AMEN1KDM4ESMN1; 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 90 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2506966-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2017-08-16 EP claimed
EP-2506965-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2016-11-09 EP claimed
US-9409154-B2 Process for producing Sn-comprising catalysts BASF SE (DE) 2016-08-09 US claimed
EP-2225029-B1 METHOD AND CATALYST FOR PRODUCING AN AMINE BASF SE (DE) 2016-08-03 EP claimed
EP-2780109-B1 PROCESS FOR PRODUCING SN-CONTAINING CATALYSTS BASF SE (DE) 2016-04-13 EP claimed
US-9174201-B2 Method for the continuous production of an amine using an aluminum—copper catalyst BASF SE (DE) 2015-11-03 US claimed
US-20150224480-A1 PROCESS FOR PRODUCING SN-COMPRISING CATALYSTS BASF SE (DE) 2015-08-13 US claimed
EP-2780109-A1 PROCESS FOR PRODUCING SN-CONTAINING CATALYSTS BASF SE (DE) 2014-09-24 EP claimed
EP-2346602-B1 METHOD FOR THE CONTINUOUS PRODUCTION OF AN AMINE USING AN ALUMINIUM-COPPER CATALYST BASF SE (DE) 2014-03-19 EP claimed
US-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN BASF SE (DE) 2013-11-21 US claimed
US-20100274008-A1 METHOD FOR THE PRODUCTION OF AN AMINE BASF SE (DE) 2010-10-28 US claimed
US-20100274011-A1 METHOD FOR THE PRODUCTION OF AN AMINE BASF SE (DE) 2010-10-28 US claimed
US-20100274010-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2010-10-28 US claimed
US-7754922-B2 Process for preparing amines and zirconium dioxide- and nickel-containing catalysts for use therein BASF SE (DE) 2010-07-13 US claimed
US-20100010264-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2010-01-14 US claimed
US-20090312579-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-12-17 US claimed
US-20090286977-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-11-19 US claimed
US-20090275781-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-11-05 US claimed
US-20090264652-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-10-22 US claimed
EP-0177905-A2 Process for the development and stripping of photoresist layers with quaternary ammonium compounds HOECHST JAPAN KABUSHIKI KAISHA (JP) 1986-04-16 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 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-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN AOC3, SCO2, SOD1 TSHR 2054/4885MAPK1 82/4885KMT2A 1213/4885
US-20100274010-A1 METHOD FOR PRODUCING AN AMINE SCO2, AOC3, AOC2 TSHR 1155/4885MAPK1 3398/4885KMT2A 206/4885
US-20090312579-A1 METHOD FOR PRODUCING AN AMINE AOC3, AOC2, ADH5 TSHR 2035/4885MAPK1 3771/4885KMT2A 137/4885
US-20100274008-A1 METHOD FOR THE PRODUCTION OF AN AMINE AOC3, AOC2, SOD1 TSHR 2506/4885MAPK1 3798/4885KMT2A 129/4885
US-20090275781-A1 METHOD FOR PRODUCING AN AMINE AOC3, AOC2, AOC1 TSHR 1812/4885MAPK1 2765/4885KMT2A 196/4885
US-20100010264-A1 METHOD FOR PRODUCING AN AMINE AOC2, AOC3, SOD1 TSHR 1862/4885MAPK1 3387/4885KMT2A 163/4885
US-20090286977-A1 METHOD FOR PRODUCING AN AMINE SOD1, AOC3, AOC2 TSHR 2007/4885MAPK1 3513/4885KMT2A 235/4885
US-20100274011-A1 METHOD FOR THE PRODUCTION OF AN AMINE SCO2, AOC3, AOC2 TSHR 1163/4885MAPK1 2794/4885KMT2A 429/4885
US-20090264652-A1 METHOD FOR PRODUCING AN AMINE AOC3, ADH5, ADH1A TSHR 1748/4885MAPK1 3783/4885KMT2A 175/4885

“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.