SCHEMBL21757356

SCHEMBL21757356

Cc1cc(Br)c(C)c(C)c1OCCCC(C)(C)C(=O)OCC(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 6/20 0.36
THRB P10828 6/20 0.36
TDP1 Q9NUW8 2/20 0.35
CYP1A2 P05177 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PPARA Q07869 2/20 0.35
CYP2C8 P10632 2/20 0.35
TTR P02766 1/20 0.35
CHRM1 P11229 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
ADRA1A P35348 1/20 0.35
PPARG P37231 1/20 0.35
HTR2B P41595 1/20 0.35
SLCO1B3 Q9NPD5 1/20 0.35
CISD1 Q9NZ45 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MCL1 Q07820 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
SCHEMBL21757388 0.92 THRA (0.35) THRATHRBTDP1CYP1A2SMN1; SMN2
SCHEMBL21757380 0.91 THRA (0.34) THRATHRBTDP1CYP1A2SMN1; SMN2
SCHEMBL21757358 0.90 THRA (0.34) THRATHRBTDP1CYP1A2SMN1; SMN2
SCHEMBL21757379 0.86 THRA (0.34) THRATHRBTDP1CYP1A2SMN1; SMN2
SCHEMBL21757415 0.82 PPARA (0.43) TDP1CYP1A2SMN1; SMN2PPARACYP2C8
SCHEMBL21757389 0.81 PPARA (0.40) TDP1CYP1A2SMN1; SMN2PPARACYP2C8
SCHEMBL21757422 0.81 PPARA (0.43) TDP1CYP1A2SMN1; SMN2PPARACYP2C8
SCHEMBL21753568 0.81 PPARA (0.52) THRATHRBTDP1CYP1A2SMN1; SMN2
SCHEMBL21757354 0.81 PPARA (0.39) TDP1CYP1A2SMN1; SMN2PPARACYP2C8
SCHEMBL21757427 0.79 PPARA (0.40) TDP1CYP1A2SMN1; SMN2PPARACYP2C8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220119333-A1 PHENOXY ACID COMPOUNDS AND MEDICAL USES THEREOF QINGDAO WHOLESOMTECH CO., LTD. (CN) 2022-04-21 US disclosed
WO-2020038464-A1 FIBRIC ACID COMPOUND AND MEDICAL USE THEREOF 北京厚燊药德科技有限责任公司 2020-02-27 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 (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-20220119333-A1 PHENOXY ACID COMPOUNDS AND MEDICAL USES THEREOF PYGL, SLC10A1, GYS2 THRA 1202/4885THRB 1343/4885TDP1 4358/4885

“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.