SCHEMBL31663516

SCHEMBL31663516

N#Cc1cccc(-c2ccccc2-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.47
USP8 P40818 1/20 0.43
USP7 Q93009 1/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
GALR3 O60755 1/20 0.42
GAA P10253 1/20 0.42
PDK2 Q15119 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MDM2 Q00987 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL27365154 1.00 ESR2 (0.47) ESR2USP8USP7ALDH1A1KDM4E
SCHEMBL565466 0.92 ESR2 (0.50) ESR2USP8USP7ALDH1A1KDM4E
SCHEMBL18411431 0.88 ESR2 (0.50) ESR2ALDH1A1KDM4EHPGDGALR3
SCHEMBL18411313 0.85 ESR2 (0.47) ESR2ALDH1A1KDM4EHPGDGALR3
SCHEMBL31663558 0.84 GABRG2 (0.50) USP8USP7ALDH1A1KDM4EHPGD
SCHEMBL565467 0.84 ESR2 (0.59) ESR2USP8USP7ALDH1A1KDM4E
SCHEMBL29977886 0.84 ESR2 (0.59) ESR2USP8USP7ALDH1A1KDM4E
SCHEMBL18411452 0.83 TSHR (0.46) ESR2ALDH1A1KDM4EHPGDPDK2
SCHEMBL26553215 0.82 ESR2 (0.39) ESR2USP8USP7ALDH1A1KDM4E
SCHEMBL30968875 0.81 SMN1; SMN2 (0.43) ESR2ALDH1A1KDM4EHPGDGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250359476-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX INC (JP) 2025-11-20 US disclosed
US-12369492-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2025-07-22 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 (2 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-20250359476-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, SLCO1B3, NDUFV3 ESR2 318/4885USP8 4237/4885USP7 4206/4885
US-12369492-B2 Composition of matter for use in organic light-emitting diodes CRY2, SLCO1B3, NDUFV3 ESR2 318/4885USP8 4237/4885USP7 4206/4885

“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.