SCHEMBL14211798

SCHEMBL14211798

CCCCCCOc1ccc(C)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
THRB P10828 3/20 0.42
THRA P10827 2/20 0.42
MAPT P10636 2/20 0.41
NR5A1 Q13285 1/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2B P41595 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CHUK O15111 1/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 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
SCHEMBL14211797 0.98 L3MBTL1 (0.43) ESR1L3MBTL1THRBTHRAMAPT
SCHEMBL16852425 0.94 ESR1 (0.41) ESR1L3MBTL1THRBTHRAMAPT
SCHEMBL12113646 0.94 ESR1 (0.41) ESR1L3MBTL1THRBTHRAMAPT
SCHEMBL14211796 0.93 CYP2C19 (0.43) ESR1L3MBTL1MAPTNR5A1LMNA
SCHEMBL16852417 0.92 L3MBTL1 (0.39) ESR1L3MBTL1THRBTHRAMAPT
SCHEMBL19160557 0.89 NR5A1 (0.50) L3MBTL1THRBTHRAMAPTNR5A1
SCHEMBL19160350 0.89 NR5A1 (0.50) L3MBTL1THRBTHRAMAPTNR5A1
SCHEMBL19160763 0.89 NR5A1 (0.50) L3MBTL1THRBTHRAMAPTNR5A1
SCHEMBL19160349 0.87 L3MBTL1 (0.46) ESR1L3MBTL1THRBTHRAMAPT
SCHEMBL19160420 0.87 L3MBTL1 (0.55) ESR1L3MBTL1THRBTHRAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357637-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-11-09 US disclosed
US-9982194-B2 Liquid-crystalline media MERECK PATENT GMBH (DE) 2018-05-29 US disclosed
US-20180119010-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-05-03 US disclosed
US-20170306232-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-10-26 US disclosed
US-9777216-B2 Liquid crystalline medium MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2017-10-03 US disclosed
US-20170044436-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-02-16 US disclosed
US-20160208170-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-07-21 US disclosed
US-9347002-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2016-05-24 US disclosed
US-20150203758-A1 LIQUID-CRYSTALLINE MEDIA MERCK PATENT GMBH (DE) 2015-07-23 US disclosed
US-20150036095-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-02-05 US disclosed
US-20140028964-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-01-30 US disclosed
US-20130207038-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2013-08-15 US disclosed
US-20130183460-A1 LIQUID-CRYSTALLINE MEDIA MERCK PATENT GMBH (DE) 2013-07-18 US disclosed
US-20120305843-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-12-06 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 (2 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-20160208170-A1 LIQUID-CRYSTALLINE MEDIUM NEFM, VIM, PLG ESR1 2400/4885L3MBTL1 4366/4885THRB 4351/4885
US-20120305843-A1 LIQUID CRYSTALLINE MEDIUM NEFM, VIM, PLG ESR1 3264/4885L3MBTL1 3925/4885THRB 4430/4885

“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.