SCHEMBL25682450

SCHEMBL25682450

Cn1c2ccccc2c2c3sc4c(C(C)(C)C)cccc4c3ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.41
▸ NQO2 P16083 1/20 0.40
▸ MAPT P10636 5/20 0.38
▸ HTT P42858 2/20 0.38
▸ KIF11 P52732 2/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ GABRP O00591 2/20 0.35
▸ GABRD O14764 2/20 0.35
▸ GABRA1 P14867 2/20 0.35
▸ GABRB1 P18505 2/20 0.35
▸ GABRG2 P18507 2/20 0.35
▸ GABRB3 P28472 2/20 0.35
▸ GABRA5 P31644 2/20 0.35
▸ GABRA3 P34903 2/20 0.35
▸ GABRA2 P47869 2/20 0.35
▸ GABRB2 P47870 2/20 0.35
▸ GABRA4 P48169 2/20 0.35
▸ GABRE P78334 2/20 0.35
▸ GABRA6 Q16445 2/20 0.35
▸ GABRG1 Q8N1C3 2/20 0.35

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
SCHEMBL25682427 0.86 GPR3 (0.39) GPR3NQO2MAPTHTTKIF11
SCHEMBL25993506 0.85 GPR3 (0.40) GPR3NQO2MAPTHTTKIF11
SCHEMBL15447745 0.83 KDM4E (0.42) MAPTKIF11KDM4EALDH1A1HPGD
SCHEMBL25682451 0.82 GPR3 (0.36) GPR3NQO2MAPTHTTKIF11
SCHEMBL25682667 0.82 ALKBH5 (0.47) GPR3MAPTHTTKIF11KDM4E
SCHEMBL13183789 0.81 GPR3 (0.47) GPR3NQO2MAPTHTTKIF11
SCHEMBL25523152 0.80 GPR3 (0.54) GPR3NQO2MAPTHTTKIF11
SCHEMBL25682449 0.80 KIF11 (0.43) GPR3NQO2MAPTHTTKIF11
SCHEMBL25993483 0.78 MAPT (0.34) GPR3MAPTHTTKIF11KDM4E
SCHEMBL25993604 0.78 GPR3 (0.41) GPR3NQO2MAPTHTTKIF11

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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT KYULUX, INC. (JP) 2023-08-24 — — US disclosed
US-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT KYULUX, INC. (JP) 2023-08-24 — — US disclosed
EP-4190791-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT Kyulux, Inc. (JP) 2023-06-07 — — EP 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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT CRY1, CCNE2, CRY2 GPR3 1535/4885NQO2 1364/4885MAPT 1225/4885

“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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