SCHEMBL29874076

SCHEMBL29874076

[2H]C([2H])(c1ccnc(Br)c1)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.37
▸ PARP1 P09874 1/20 0.35
▸ LOXL2 Q9Y4K0 3/20 0.34
▸ LOX P28300 2/20 0.34
▸ NOS3 P29474 1/20 0.33
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ HCRTR2 O43614 1/20 0.32
▸ RXRA P19793 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ CTSK P43235 1/20 0.30

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
SCHEMBL14706743 0.80 AR (0.42) ARPARP1LOXL2LOXNOS3
SCHEMBL21331552 0.79 LOX (0.53) LOXL2LOXNOS3NOS1NOS2
SCHEMBL29183418 0.76 AR (0.36) ARPARP1LOXL2LOXNOS3
SCHEMBL648113 0.75 — —
SCHEMBL30792294 0.73 AR (0.48) ARPARP1LOXL2LOX
SCHEMBL30514178 0.73 — —
SCHEMBL1639940 0.73 — —
SCHEMBL1874470 0.72 NOS2 (0.39) ARPARP1LOXL2LOXNOS3
SCHEMBL29873704 0.72 AR (0.41) ARPARP1LOXL2LOXNOS2
SCHEMBL1166695 0.72 LOX (0.34) ARPARP1LOXL2LOXNOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260123267-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2026-04-30 — — US disclosed
US-12534486-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2026-01-27 — — US disclosed
US-20220306667-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-09-29 — — US disclosed
EP-4059942-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2022-09-21 — — 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 (3 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-12534486-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device L1CAM, CYBA, SCO2 AR 2231/4885PARP1 2016/4885LOXL2 10/4885
US-20260123267-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE CYBA, CRY1, SCO2 AR 2406/4885PARP1 2978/4885LOXL2 431/4885
US-20220306667-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE CYBA, CYC1, L1CAM AR 2362/4885PARP1 2404/4885LOXL2 59/4885

“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.

Send feedback