SCHEMBL5047779

SCHEMBL5047779

C=Cc1cccc(C(=O)OC)c1C=C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CFTR P13569 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA5A P35218 1/20 0.44
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
ATM Q13315 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 3/20 0.41
BACE1 P56817 1/20 0.40
MAPT P10636 2/20 0.40
ALOX15 P16050 1/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40

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
SCHEMBL16955450 0.90 LMNA (0.43) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL22481046 0.89 TSHR (0.52) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL5323674 0.86 CYP3A4 (0.38) LMNATSHRALDH1A1HSD17B10KDM4E
SCHEMBL61520 0.84 TSHR (0.55) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL7860403 0.84 LMNA (0.41) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL5198420 0.83 KDM4E (0.57) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL16958924 0.83 ALDH1A1 (0.48) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL30280797 0.83 ALDH1A1 (0.48) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL8074147 0.83 CA1 (0.48) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL7869865 0.83 NR4A2 (0.46) LMNATSHRALDH1A1HSD17B10CFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
US-20120164027-A1 Polymer Based Lanthanide Luminescent Sensors for the Detection of Organophosphorus Compounds MURRAY GEORGE M (US) 2012-06-28 US disclosed
US-7416703-B2 Polymer based lanthanide luminescent sensors for the detection of organophosphorus compounds THE JOHNS HOPKINS UNIVERSITY (US) 2008-08-26 US disclosed
US-20050019218-A1 Polymer based lanthanide luminescent sensors for the detection of organophosphorus compounds MURRAY GEORGE M (US) 2005-01-27 US disclosed
US-20040265178-A1 Molecularly imprinted polymer solution anion sensor MURRAY GEORGE M (US) 2004-12-30 US disclosed
EP-1436599-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR The Johns Hopkins University (US) 2004-07-14 EP disclosed
US-6749811-B2 QUANTITATIVE ANALYSIS; USING POLYMER BOUND TO RARE EARTH COMPOUND; WATER POLLUTION CONTROL THE JOHNS HOPKINS UNIVERSITY 2004-06-15 US disclosed
US-20030129092-A1 Molecularly imprinted polymer solution anion sensor JOHN HOPKINS UNIVERSITY, THE 2003-07-10 US disclosed
WO-2003034043-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR THE JOHNS HOPKINS UNIVERSTIY (US) 2003-04-24 WO disclosed