SCHEMBL26579482

SCHEMBL26579482

CC(C)(C)c1cc(C(C)(C)C)c2ccccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
TSHR P16473 2/20 0.39
NR1I2 O75469 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KIF11 P52732 3/20 0.39
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HIF1A Q16665 1/20 0.38
CYP1B1 Q16678 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP2A6 P11509 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
PTPN1 P18031 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 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
SCHEMBL23565161 0.86 PTPN1 (0.39) CYP1A2TSHRKIF11ALDH1A1HIF1A
SCHEMBL24817483 0.86 ALDH1A1 (0.34) CYP1A2TSHRNR1I2KIF11LMNA
SCHEMBL24631890 0.86 BACE1 (0.42) CYP1A2KIF11ALDH1A1HIF1ACYP1B1
SCHEMBL22747181 0.81 CYP1A2 (0.59) CYP1A2TSHRKIF11ALDH1A1HIF1A
SCHEMBL7955337 0.81 ALDH1A1 (0.42) CYP1A2TSHRNR1I2KIF11LMNA
SCHEMBL24712674 0.79 CYP1A2 (0.57) CYP1A2TSHRCYP2C9CYP2C19KIF11
SCHEMBL15853141 0.79 CYP1A2 (0.41) CYP1A2TSHRKIF11ALDH1A1HIF1A
SCHEMBL12401757 0.78 CYP2A6 (0.40) CYP1A2TSHRKIF11ALDH1A1HIF1A
SCHEMBL21085333 0.78 ALDH1A1 (0.37) CYP1A2TSHRCYP2C19KIF11ALDH1A1
SCHEMBL2454488 0.78 CYP2A6 (0.40) CYP1A2TSHRKIF11ALDH1A1HIF1A

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-11820783-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-11-21 US disclosed
US-20230337523-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-19 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 (2 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-11820783-B2 Organic electroluminescent materials and devices LOXL1, ILK, SOD1 CYP1A2 2483/4885TSHR 2054/4885NR1I2 1032/4885
US-20230337523-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LBR, OCIAD1, OCIAD2 CYP1A2 1850/4885TSHR 296/4885NR1I2 304/4885

“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.