SCHEMBL25704074

SCHEMBL25704074

Bc1c(B)c(B)c(-c2ccc3[nH]c4ccc5oc6ccccc6c5c4c3c2)c(B)c1B

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ CDK4 P11802 2/20 0.36
▸ CCND1 P24385 2/20 0.36
▸ HCRTR1 O43613 1/20 0.34
▸ CHEK2 O96017 1/20 0.34
▸ CHEK1 O14757 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PLA2G2A P14555 3/20 0.32
▸ PLA2G4A P47712 3/20 0.32
▸ CDK5 Q00535 2/20 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
SCHEMBL25704008 0.85 GABRP (0.39) CASP3SENP7SENP6CDK4CCND1
SCHEMBL25704040 0.85 JAK2 (0.41) CASP3SENP7SENP6CDK4CCND1
SCHEMBL25689073 0.83 CDK4 (0.51) CASP3SENP7SENP6CDK4CCND1
SCHEMBL22954029 0.79 CDK4 (0.52) CASP3SENP7SENP6CDK4CCND1
SCHEMBL24027684 0.79 CDK4 (0.44) CASP3SENP7SENP6CDK4CCND1
SCHEMBL17948240 0.78 GABRP (0.50) CDK4CCND1KDM4EMEN1NPC1
SCHEMBL29641937 0.78 GABRP (0.50) CDK4CCND1KDM4EMEN1NPC1
SCHEMBL29819495 0.78 GABRP (0.50) CDK4CCND1KDM4EMEN1NPC1
SCHEMBL24728572 0.77 CDK4 (0.54) CASP3SENP7SENP6CDK4CCND1
SCHEMBL19573727 0.77 CASP3 (0.41) CASP3SENP7SENP6CDK4CCND1

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-20230210000-A1 COMPOUND, LIGHT EMITTING MATERIAL, AND LIGHT EMITTING DEVICE KYULUX, INC. (JP) 2023-06-29 — — 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-20230210000-A1 COMPOUND, LIGHT EMITTING MATERIAL, AND LIGHT EMITTING DEVICE DRD1, DRD2, DRD3 CASP3 3750/4885SENP7 1901/4885SENP6 3135/4885

“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.

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