SCHEMBL23522296

SCHEMBL23522296

CC(C)c1cccc(B(O)O)c1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRB2 P47870 2/20 0.42
LMNA P02545 2/20 0.42
FAAH O00519 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
GABRB1 P18505 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
HTR2C P28335 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
HTR2B P41595 1/20 0.42
GABRA2 P47869 1/20 0.42

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
SCHEMBL954191 0.82 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1527132 0.77 GABRA1 (0.54) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL3426311 0.76 MEN1 (0.44) LMNACA1CA2TSHRBLM
SCHEMBL21270 0.75 GABRA1 (0.54) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL29430856 0.75 GABRA1 (0.54) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL6216932 0.75 TSHR (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL6208275 0.75 ALDH1A1 (0.45) CA1CA2TSHRKMT2AMEN1
SCHEMBL29952004 0.75 TSHR (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL320584 0.73 ALDH1A1 (0.61) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1984475 0.73 ALDH1A1 (0.61) LMNACYP1A2TSHRSLC6A2HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12137604-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-11-05 US disclosed
CN-113004337-B Organometallic compound and organic light emitting device including the same 三星电子株式会社 2024-09-20 CN disclosed
US-20210193937-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-24 US disclosed
EP-3838908-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-06-23 EP disclosed
CN-113004337-A Organometallic compound and organic light emitting device including the same 三星电子株式会社 2021-06-22 CN 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-12137604-B2 Organometallic compound and organic light-emitting device including the same CYC1, CYBA, CRY2 GABRA1 2941/4885GABRG2 3243/4885GABRB3 4208/4885
US-20210193937-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYC1, CYBA, CRY2 GABRA1 2941/4885GABRG2 3243/4885GABRB3 4208/4885

“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.