SCHEMBL1155862

SCHEMBL1155862

CCCCOc1ccc(B(O)O)cc1OCCCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
LPL P06858 7/20 0.44
LIPG Q9Y5X9 7/20 0.44
TRPV1 Q8NER1 1/20 0.43
MGLL Q99685 1/20 0.43
C5AR1 P21730 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ESR1 P03372 1/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ENPP2 Q13822 1/20 0.39
GLA P06280 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL1458309 0.95 LPL (0.47) CA1CA2LPLLIPGTRPV1
SCHEMBL6736805 0.93 LPL (0.49) CA1CA2LPLLIPGTRPV1
SCHEMBL8082305 0.92 FAAH (0.46) CA1CA2ENPP2KDR
SCHEMBL29954452 0.92 SMPD1 (0.48) CA1CA2CYP1A2MAPTENPP2
SCHEMBL3791885 0.91 MAPT (0.47) CA1CA2LPLLIPGTRPV1
SCHEMBL29954628 0.86 ESR1 (0.51) CA1CA2LPLLIPGTRPV1
SCHEMBL257737 0.85 ENPP2 (0.56) CA1CA2LPLLIPGMAPT
SCHEMBL29956963 0.85 ENPP2 (0.43) CA1CA2LPLLIPGTRPV1
SCHEMBL3789212 0.85 CYP1A2 (0.53) CA1CA2LPLLIPGTRPV1
SCHEMBL29953148 0.85 THRA (0.44) CA1CA2LPLLIPGTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11654404-B2 Light emitting droplets and related methods MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-05-23 US disclosed
EP-2818531-B1 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-07-26 EP disclosed
EP-1534722-B1 RHODIUM AND IRIDIUM COMPLEXES MERCK PATENT GMBH (DE) 2017-03-22 EP disclosed
US-9567526-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-02-14 US disclosed
EP-2842974-A1 COMPOUND HAVING FOUR POLYMERIZABLE GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2015-03-04 EP disclosed
US-20140375943-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-25 US disclosed
EP-2289902-A2 Rhodium and iridium complexes Merck Patent GmbH (DE) 2011-03-02 EP disclosed
US-7883785-B2 5'-mono-, 5',5''-bis- and 5',5'',5'''-tris-aryl/heteroaryl-functionalized tris-orthometallated organorhodium and organoiridium compounds; readily soluble triplet emitters MERCK PATENT GMBH (DE) 2011-02-08 US disclosed
EP-2256125-A2 Rhodium and iridium complexes Merck Patent GmbH (DE) 2010-12-01 EP disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed
US-20060127696-A1 Rhodium and iridium complexes COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-06-15 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 CA1 3273/4885CA2 1992/4885LPL 3816/4885

“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.