SCHEMBL23446728

SCHEMBL23446728

CC1(C)CCC(C)(C)c2cc(-c3ccccc3)c(Nc3cccc4c3C(C)(C)CCC4(C)C)cc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 11/20 0.39
▸ RXRA P19793 7/20 0.39
▸ RARG P13631 7/20 0.39
▸ RARA P10276 8/20 0.37
▸ RXRB P28702 5/20 0.36
▸ RXRG P48443 5/20 0.36
▸ TP53 P04637 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ FABP4 P15090 2/20 0.31
▸ FABP3 P05413 1/20 0.31
▸ FABP5 Q01469 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ HNF4A P41235 1/20 0.30
▸ JAK2 O60674 1/20 0.30
▸ JAK3 P52333 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
SCHEMBL27395020 0.86 RARB (0.41) RARBRXRARARGRARARXRB
SCHEMBL24442968 0.86 RARB (0.39) RARBRXRARARGRARARXRB
SCHEMBL24442807 0.82 RARB (0.43) RARBRXRARARGRARARXRB
SCHEMBL24005343 0.82 TP53 (0.43) RARBRARGRARATP53CYP1A2
SCHEMBL31676214 0.81 RXRA (0.36) RARBRXRARARGRARARXRB
SCHEMBL27395223 0.80 RARB (0.50) RARBRXRARARGRARATP53
SCHEMBL29945232 0.79 RARB (0.46) RARBRXRARARGRARARXRB
SCHEMBL23442800 0.79 RARB (0.46) RARBRXRARARGRARARXRB
SCHEMBL23442477 0.78 NPSR1 (0.47) RARBRXRARARGRXRBRXRG
SCHEMBL31375644 0.78 RARB (0.40) RARBRXRARARGRARATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780856-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2023-10-10 — — US disclosed
EP-3919500-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2021-12-08 — — EP disclosed
WO-2021107681-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO 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-11780856-B2 Compound and organic light-emitting device comprising same CRY1, CRY2, LEF1 RARB 1767/4885RXRA 2187/4885RARG 1720/4885

“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