SCHEMBL23959636

SCHEMBL23959636

CC(C)(C)c1cccc(-c2cc(-c3cc(-c4cccc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c4)cc(-c4cc(-c5cccc(C(C)(C)C)c5)cc(C(C)(C)C)c4)n3)cc(C(C)(C)C)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.54
RXRB P28702 7/20 0.49
RXRA P19793 6/20 0.49
CTSS P25774 1/20 0.45
CTSK P43235 1/20 0.45
CNR1 P21554 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
RXRG P48443 3/20 0.38
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
S1PR1 P21453 1/20 0.36

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
SCHEMBL23959632 0.96 RXRB (0.51) KIF11RXRBRXRACTSSCTSK
SCHEMBL23729372 0.96 RXRB (0.51) KIF11RXRBRXRACTSSCTSK
SCHEMBL23959625 0.90 KIF11 (0.51) KIF11RXRBRXRACTSSCTSK
SCHEMBL23959652 0.90 RXRB (0.53) KIF11RXRBRXRACNR1MAPT
SCHEMBL20089422 0.90 KIF11 (0.54) KIF11RXRBRXRACTSSCTSK
SCHEMBL23959672 0.90 RXRB (0.53) KIF11RXRBRXRACNR1MAPT
SCHEMBL23959671 0.90 RXRB (0.53) KIF11RXRBRXRACNR1MAPT
SCHEMBL23959670 0.90 RXRB (0.53) KIF11RXRBRXRACNR1MAPT
SCHEMBL23959761 0.88 RXRB (0.55) KIF11RXRBRXRACTSSCTSK
SCHEMBL19735237 0.88 KIF11 (0.56) KIF11RXRBRXRACTSSCTSK

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-20210336151-A1 Light-Emitting Device Material, Electron-Transport Layer Material, Organic Compound, Light-Emitting Device, Light-Emitting Apparatus, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-10-28 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-20210336151-A1 Light-Emitting Device Material, Electron-Transport Layer Material, Organic Compound, Light-Emitting Device, Light-Emitting Apparatus, Electronic Device, and Lighting Device SPIN3, SLC39A3, SKIC3 KIF11 3007/4885RXRB 3264/4885RXRA 2544/4885

“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.