SCHEMBL26529319

SCHEMBL26529319

CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3)cc(-c3ccc4c(c3)c3cc(-c5cc(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)cc(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c5)ccc3n4-c3ccccc3-c3ccccc3C(F)(F)F)c2)cc(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.39
ALDH1A1 P00352 3/20 0.35
CYP1A2 P05177 3/20 0.35
CYP3A4 P08684 3/20 0.35
TSHR P16473 3/20 0.35
MAPK1 P28482 3/20 0.35
CYP2C19 P33261 3/20 0.35
USP2 O75604 2/20 0.35
CYP2D6 P10635 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35
ICMT O60725 2/20 0.35
HSD11B1 P28845 7/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
HIF1A Q16665 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
AR P10275 1/20 0.33
LMNA P02545 1/20 0.32
TP53 P04637 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
SCHEMBL26539535 0.94 TRPA1 (0.41) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26529307 0.93 TRPA1 (0.38) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26529312 0.93 TRPA1 (0.39) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26538091 0.93 TRPA1 (0.38) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26539273 0.92 ICMT (0.38) TRPA1ICMTMEN1KMT2A
SCHEMBL26529410 0.91 RXRB (0.33) TRPA1ICMT
SCHEMBL26539270 0.91 TRPA1 (0.42) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26530682 0.91 TRPA1 (0.42) TRPA1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL26528995 0.90 RXRB (0.34) TRPA1ICMT
SCHEMBL26529137 0.90 ALDH1A1 (0.37) TRPA1ALDH1A1CYP1A2CYP3A4MAPK1

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-20230329101-A1 Organic Light Emitting Compound And Organic Light Emitting Device Including Same P&h Tech Co., Ltd. (KR) 2023-10-12 US disclosed
US-20230329101-A1 Organic Light Emitting Compound And Organic Light Emitting Device Including Same P&h Tech Co., Ltd. (KR) 2023-10-12 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-20230329101-A1 Organic Light Emitting Compound And Organic Light Emitting Device Including Same ORMDL3, OR10J3, ORC3 TRPA1 42/4885ALDH1A1 70/4885CYP1A2 599/4885

“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.