SCHEMBL15564752

SCHEMBL15564752

CCCCCCOc1c(F)cccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
NR5A1 Q13285 1/20 0.44
LTA4H P09960 1/20 0.43
FAAH O00519 6/20 0.43
PTPN1 P18031 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MCHR1 Q99705 1/20 0.41
NR1I2 O75469 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
MAPT P10636 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 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
SCHEMBL15295179 0.98 L3MBTL1 (0.47) TSHRL3MBTL1NR5A1LTA4HFAAH
SCHEMBL15295256 0.92 L3MBTL1 (0.44) L3MBTL1LTA4HFAAHTDP1MEN1
SCHEMBL29234061 0.88 NR5A1 (0.46) TSHRL3MBTL1NR5A1LTA4HFAAH
SCHEMBL9850762 0.88 TSHR (0.41) TSHRL3MBTL1NR5A1LTA4HFAAH
SCHEMBL6742020 0.88 NR5A1 (0.47) TSHRL3MBTL1NR5A1LTA4HTDP1
SCHEMBL29234053 0.85 NR5A1 (0.43) TSHRL3MBTL1NR5A1LTA4HFAAH
SCHEMBL15295193 0.85 L3MBTL1 (0.41) TSHRL3MBTL1LTA4HTDP1KMT2A
SCHEMBL15923839 0.84 ALDH1A1 (0.44) TSHRL3MBTL1FAAHPTPN1ALDH1A1
SCHEMBL17208965 0.82 NR5A1 (0.43) TSHRL3MBTL1NR5A1LTA4HFAAH
SCHEMBL10772991 0.82 PTPN1 (0.54) TSHRPTPN1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2882765-B1 ORGANOMETALLIC LIGHT EMITTING COMPOUNDS BASED ON TWO TRIDENTATE LIGANDS CONNECTED THROUGH A HETEROCYCLIC MOIETY MERCK PATENT GMBH (DE) 2021-01-20 EP disclosed
US-10752780-B2 Chromophores for photochromic compositions useful for three dimensional display applications NITTO DENKO CORPORATION (JP) 2020-08-25 US disclosed
US-9911929-B2 Light emitting compounds MERCK PATENT GMBH (DE) 2018-03-06 US disclosed
US-9911929-B2 Light emitting compounds MERCK PATENT GMBH (DE) 2018-03-06 US disclosed
US-20170044373-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2017-02-16 US disclosed
US-20170044373-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2017-02-16 US disclosed
US-20160359124-A1 LIGHT EMITTING COMPOUNDS UDC IRELAND LIMITED (IE) 2016-12-08 US disclosed
US-20160359124-A1 LIGHT EMITTING COMPOUNDS UDC IRELAND LIMITED (IE) 2016-12-08 US disclosed
US-9461255-B2 Light emitting compounds MERCK PATENT GMBH (DE) 2016-10-04 US disclosed
US-9461255-B2 Light emitting compounds MERCK PATENT GMBH (DE) 2016-10-04 US disclosed
WO-2015164390-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2015-10-29 WO disclosed
US-20150200369-A1 LIGHT EMITTING COMPOUNDS UNIVERSITY OF NORTHUMBRIA AT NEWCASTLE (GB) 2015-07-16 US disclosed
US-20150200369-A1 LIGHT EMITTING COMPOUNDS UNIVERSITY OF NORTHUMBRIA AT NEWCASTLE (GB) 2015-07-16 US disclosed
CN-104781267-A Light emitting compounds UNIV NORTHUMBRIA NEWCASTLE 2015-07-15 CN disclosed
EP-2882765-A1 LIGHT EMITTING COMPOUNDS University of Northumbria at Newcastle (GB) 2015-06-17 EP disclosed
WO-2014023972-A1 LIGHT EMITTING COMPOUNDS UNIVERSITY OF NORTHUMBRIA AT NEWCASTLE (GB) 2014-02-13 WO 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 (3 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-20160359124-A1 LIGHT EMITTING COMPOUNDS OCIAD1, OCIAD2, YAP1 TSHR 3044/4885L3MBTL1 252/4885NR5A1 1432/4885
US-20150200369-A1 LIGHT EMITTING COMPOUNDS OCIAD1, OCIAD2, YAP1 TSHR 3044/4885L3MBTL1 252/4885NR5A1 1432/4885
US-10752780-B2 Chromophores for photochromic compositions useful for three dimensional display applications CRY1, RB1, BRD3 TSHR 4020/4885L3MBTL1 1594/4885NR5A1 3263/4885

“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.