SCHEMBL2197374

SCHEMBL2197374

CC(C)(c1ccccc1)c1cc(Cl)cc(C=O)c1O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 11/20 0.51
CNR1 P21554 3/20 0.46
CNR2 P34972 3/20 0.46
ALDH1A1 P00352 3/20 0.39
ESR1 P03372 1/20 0.39
CYP3A4 P08684 1/20 0.39
ESR2 Q92731 1/20 0.39
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL30829189 0.85 ESR1 (0.44) ERN1CNR1CNR2ALDH1A1ESR1
SCHEMBL3241119 0.85 ESR1 (0.44) ERN1CNR1CNR2ALDH1A1ESR1
SCHEMBL15771550 0.84 ALOX5 (0.48) ERN1ALDH1A1ESR1CYP3A4ESR2
SCHEMBL1685305 0.84 ERN1 (0.53) ERN1CNR1CNR2ALDH1A1ESR1
SCHEMBL12424560 0.83 CNR1 (0.43) CNR1CNR2ALDH1A1ESR1CYP3A4
SCHEMBL6446758 0.80 ERN1 (0.45) ERN1ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL310827 0.79 ERN1 (0.64) ERN1ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL1685290 0.78 ERN1 (0.47) ERN1CNR1CNR2ALDH1A1ESR1
SCHEMBL9251319 0.78 AKR1C2 (0.49) CNR1CNR2ALDH1A1ESR1CYP3A4
Butane SCHEMBL27959903 0.73 ERN1 (0.42) ERN1ALDH1A1ESR1CYP3A4ESR2

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
EP-1719794-B1 NOVEL POLYMERS AND USES THEREOF MITSUI CHEMICALS INC (JP) 2017-01-04 EP disclosed
EP-2166027-B1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION MITSUI CHEMICALS INC (JP) 2015-06-10 EP disclosed
US-8513362-B2 Polyolefin polymer having polar group, method for production thereof, and water dispersion material and mold release agent composition MITSUI CHEMICALS, INC. (JP) 2013-08-20 US disclosed
CN-101817929-B Novel polymers and uses thereof MITSUI CHEMICALS INC 2012-08-22 CN disclosed
CN-101687944-B Polar group-containing polyolefin polymer, process for producing the same, aqueous dispersion, and mold release agent composition MITSU CHEMICALS INC 2012-07-25 CN disclosed
CN-1914253-B Polymer and use thereof MITSUI CHEMICALS INC 2011-08-31 CN disclosed
US-7977429-B2 Polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2011-07-12 US disclosed
CN-101817929-A Novel polymers and uses thereof MITSUI CHEMICALS INC 2010-09-01 CN disclosed
US-20100113728-A1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION MITSUI CHEMICALS, INC. 2010-05-06 US disclosed
CN-101687944-A Polar group-containing polyolefin polymer, process for producing the same, aqueous dispersion, and mold release agent composition MITSUI CHEMICALS INC 2010-03-31 CN disclosed
EP-2166027-A1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION Mitsui Chemicals, Inc. (JP) 2010-03-24 EP disclosed
US-20070154431-A1 Novel polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-07-05 US disclosed
CN-1914253-A Novel polymers and uses thereof MITSUI CHEMICALS INC (JP) 2007-02-14 CN disclosed
EP-1719794-A1 NOVEL POLYMERS AND USES THEREOF Mitsui Takeda Chemicals, Inc. (JP) 2006-11-08 EP 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-20070154431-A1 Novel polymers and uses thereof RAD54L, VCL, TYR ERN1 4354/4885CNR1 944/4885CNR2 1768/4885

“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.