SCHEMBL4194741

SCHEMBL4194741

C=C(C)C(=O)OC(COc1ccc(Oc2ccccc2)cc1)COc1c(C)cc(-c2cc(C)c(OCC(COc3ccc(Oc4ccccc4)cc3)OC(=O)C(=C)C)c(C)c2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
LTA4H P09960 1/20 0.38
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
PPARA Q07869 2/20 0.36
PPARG P37231 1/20 0.36
FFAR4 Q5NUL3 2/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL4198613 0.95 THRB (0.43) THRBMTNR1AMTNR1BPOLBMAPT
SCHEMBL4197210 0.92 MAPT (0.41) THRBSMN1; SMN2MAPTPPARAPPARG
SCHEMBL19944473 0.88 LTA4H (0.47) LTA4HHTR1DHTR1BMTNR1AMTNR1B
SCHEMBL4202672 0.88 RXRA (0.42) THRBPPARAPPARGFFAR1
SCHEMBL4198638 0.88 MAPT (0.41) THRBSMN1; SMN2MAPTPPARAPPARG
SCHEMBL4199988 0.87 ACACB (0.45) LTA4HMTNR1AMTNR1BSMN1; SMN2POLB
SCHEMBL4198600 0.87 MAPK1 (0.40) POLBPPARAPPARG
SCHEMBL4193730 0.84 THRB (0.40) THRBLTA4HHTR1DHTR1BSMN1; SMN2
SCHEMBL4197201 0.83 MAPT (0.47) MTNR1AMTNR1BSMN1; SMN2POLBMAPT
SCHEMBL19944372 0.83 MTNR1A (0.50) THRBMTNR1AMTNR1BPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1627867-B1 (METH)ACRYLIC ESTER COMPOUND AND USE THEREOF MITSUI CHEMICALS INC (JP) 2016-01-20 EP disclosed
US-7534909-B2 (Meth) acrylic ester compound and use thereof MITSUI CHEMICALS, INC. (JP) 2009-05-19 US disclosed
US-20070078198-A1 (Meth) acrylic ester compound and use thereof MITSUI CHEMICALS, INC. (JP) 2007-04-05 US disclosed
EP-1627867-A1 (METH)ACRYLIC ESTER COMPOUND AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2006-02-22 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-20070078198-A1 (Meth) acrylic ester compound and use thereof METTL14, PAM, TAS2R41 THRB 1009/4885LTA4H 1710/4885HTR1D 643/4885

“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.