SCHEMBL24344601

SCHEMBL24344601

CSc1c(C(C)C)cc(C(C)C)cc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
FABP3 P05413 2/20 0.36
FABP4 P15090 2/20 0.36
FABP5 Q01469 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
SCHEMBL8884997 0.82 GABRA1 (0.46) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL24344711 0.81 CYP1A2 (0.38) CYP1A2CYP2D6
SCHEMBL1087552 0.73 GABRA1 (0.59) CYP1A2CYP2D6GABRA1GABRB2FABP3
SCHEMBL31502507 0.71 GABRA1 (0.48) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL915884 0.71 GABRA1 (0.48) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL24344597 0.70 CYP1A2 (0.38) CYP1A2CYP2D6GABRA1GABRB2FABP3
SCHEMBL19619459 0.69 GABRA1 (0.46) CYP1A2CYP2D6GABRA1GABRB2FABP3
SCHEMBL809764 0.68 CYP1A2 (0.54) CYP1A2CYP2D6GABRA1GABRB2FABP3
SCHEMBL10891788 0.68 ALOX15 (0.39) CYP1A2CYP2D6GABRA1GABRB2
SCHEMBL23172717 0.67 CYP1A2 (0.44) CYP1A2CYP2D6GABRA1GABRB2FABP3

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-20220085302-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-03-17 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-20220085302-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LIFR, LBR, EPOR CYP1A2 1500/4885CYP2D6 1945/4885GABRA1 460/4885

“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.