SCHEMBL31071024

SCHEMBL31071024

CC(C)(C)c1cc(Br)cc(-c2cc(Br)cc(C(C)(C)C)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRB P28702 7/20 0.41
RXRA P19793 6/20 0.41
RXRG P48443 3/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
POLB P06746 1/20 0.37
S1PR1 P21453 2/20 0.34
S1PR3 Q99500 2/20 0.34
HIF1A Q16665 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KIF11 P52732 1/20 0.33
HTR1D P28221 1/20 0.32

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
SCHEMBL29416703 0.97 GABRA1 (0.44) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL23915436 0.97 GABRA1 (0.44) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL29436334 0.95 RXRB (0.42) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL23909387 0.95 RXRB (0.42) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL18537286 0.92 GABRA1 (0.44) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL28375569 0.92 GABRA1 (0.44) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL23915063 0.91 RXRB (0.53) RXRBRXRARXRGGABRA1GABRB2
SCHEMBL31442862 0.89 RXRB (0.47) RXRBRXRARXRGKIF11ALDH1A1
SCHEMBL19274316 0.87 RXRB (0.46) RXRBRXRARXRGKIF11ALDH1A1
SCHEMBL190968 0.86 GABRA1 (0.52) RXRBRXRARXRGGABRA1GABRB2

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-20240298537-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2024-09-05 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-20240298537-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND LAGE3, NQO1, CRY1 RXRB 2766/4885RXRA 1987/4885RXRG 2277/4885

“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.