SCHEMBL13673476

SCHEMBL13673476

CC(C)(C)c1cc(N(O)O)cc(C(C)(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
CYP2C19 P33261 2/20 0.39
POLB P06746 1/20 0.37
RXRB P28702 8/20 0.37
RXRA P19793 7/20 0.37
RXRG P48443 6/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.35
TYR P14679 1/20 0.35
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HTR1D P28221 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL14372107 0.84 GABRA1 (0.52) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL22181552 0.81 GABRA1 (0.48) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL14372106 0.80 GABRA1 (0.48) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL11955385 0.77 HDAC8 (0.47) GABRA1GABRB2RXRBRXRAALDH1A1
SCHEMBL93161 0.76 GABRA1 (0.69) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL345598 0.76 GABRA1 (0.48) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL26849561 0.75 NOTUM (0.44) POLBALDH1A1HPGDALOX15TDP1
SCHEMBL23051506 0.74 GABRA1 (0.46) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL24522084 0.74 GABRA1 (0.46) GABRA1GABRB2CYP2C19POLBRXRB
SCHEMBL13673475 0.74 LMNA (0.52) ALDH1A1HPGDALOX15HSD17B10TDP1

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-20230217804-A1 LIGHT EMITTING ELEMENT SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-06 US disclosed
EP-2112213-A2 Organic electroluminescence device, novel platinum complex compound and novel compound capable of being a ligand thereof FUJIFILM Corporation (JP) 2009-10-28 EP 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-20230217804-A1 LIGHT EMITTING ELEMENT NR2E3, CRY1, CRY2 GABRA1 468/4885GABRB2 576/4885CYP2C19 621/4885

“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.