SCHEMBL12567796

SCHEMBL12567796

C=CC(=O)OCc1ccc(C(=O)Oc2ccc(-c3ccc(CC(C)CC)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.42
▸ MAPT P10636 7/20 0.39
▸ TP53 P04637 1/20 0.39
▸ PPARG P37231 3/20 0.38
▸ KMT2A Q03164 4/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ PPARD Q03181 3/20 0.36
▸ PPARA Q07869 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ ACACB O00763 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KDM4E B2RXH2 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
SCHEMBL10308954 0.89 THRB (0.41) THRBMAPTTP53PPARGKMT2A
SCHEMBL10018726 0.88 MAPT (0.43) THRBMAPTTP53PPARGKMT2A
SCHEMBL12242632 0.87 THRB (0.47) THRBMAPTTP53KMT2ASMN1; SMN2
SCHEMBL12242630 0.87 THRB (0.47) THRBMAPTTP53KMT2ASMN1; SMN2
SCHEMBL9996833 0.87 SMN1; SMN2 (0.43) THRBMAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL13236103 0.87 SMN1; SMN2 (0.43) THRBMAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL10018730 0.87 SMN1; SMN2 (0.43) THRBMAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9513316 0.86 TP53 (0.48) THRBMAPTTP53PPARGKMT2A
SCHEMBL20594558 0.86 TP53 (0.48) THRBMAPTTP53PPARGKMT2A
SCHEMBL10308953 0.86 THRB (0.43) THRBMAPTTP53PPARGKMT2A

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
US-8425988-B2 Polymerizable liquid crystal compound, polymerizable liquid crystal composition and anisotropic polymer JNC CORPORATION (JP) 2013-04-23 — — US disclosed
US-20120274888-A1 OPTICALLY ANISOTROPIC SUBSTANCE JNC PETROCHEMICAL CORPORATION (JP) 2012-11-01 — — US disclosed
US-20110147657-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND ANISOTROPIC POLYMER CHISSO CORPORATION (JP) 2011-06-23 — — US disclosed
US-20100297367-A1 OPTICALLY ANISOTROPIC SUBSTANCE CHISSO CORPORATION (JP) 2010-11-25 — — 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-20110147657-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND ANISOTROPIC POLYMER SSB, LEF1, UACA THRB 4550/4885MAPT 12/4885TP53 3618/4885

“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.

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