SCHEMBL27428302

SCHEMBL27428302

CC(C)c1ccc(Oc2cccc(CC(C)c3ccc(F)c(F)c3)c2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
TAAR1 Q96RJ0 2/20 0.37
FDFT1 P37268 3/20 0.36
IDO1 P14902 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
FFAR1 O14842 3/20 0.35
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
SCN9A Q15858 1/20 0.34
CASP1 P29466 1/20 0.33
CETP P11597 3/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL14471077 0.76 L3MBTL1 (0.46) FFAR1
SCHEMBL14470905 0.75 HTR2A (0.42) FFAR1HTR2ASLC6A4
SCHEMBL3159596 0.73 HTR2A (0.53) HTR2ASLC6A4
SCHEMBL23034491 0.73 IDO1 (0.41) TAAR1IDO1MRGPRX4FFAR1HTR2A
SCHEMBL24726460 0.72 FDFT1 (0.45) TAAR1FDFT1FFAR1CETP
SCHEMBL12808448 0.72 AKR1C3 (0.46)
SCHEMBL8172098 0.72 FDFT1 (0.47) TAAR1FDFT1HTR2ASLC6A4CETP
SCHEMBL22185245 0.71 CASP1 (0.43) HTR2ASLC6A4SCN9ACASP1
SCHEMBL8252058 0.71 FDFT1 (0.49) TAAR1FDFT1CETPPPARGPPARA
SCHEMBL12808392 0.71 CASP1 (0.43) HTR2ASLC6A4SCN9ACASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. 2024-07-04 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-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF NR3C1, NR3C2, MC2R PLG 3921/4885PLAU 4359/4885TAAR1 575/4885

“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.