SCHEMBL25993486

SCHEMBL25993486

Cn1c2c(C(C)(C)C)cccc2c2ccc3sc4ccccc4c3c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.39
▸ MAPT P10636 4/20 0.34
▸ HPGD P15428 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ DUSP3 P51452 2/20 0.34
▸ PTPN7 P35236 1/20 0.34
▸ PTPN12 Q05209 1/20 0.34
▸ PTPN22 Q9Y2R2 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PTPN5 P54829 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ NPC1 O15118 1/20 0.33

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
SCHEMBL25682550 0.85 GPR3 (0.36) GPR3MAPTHPGDRAB9AALDH1A1
SCHEMBL25682736 0.84 GPR3 (0.37) GPR3MAPTHPGDRAB9ADUSP3
SCHEMBL25682628 0.83 MAPT (0.39) GPR3MAPTHPGDRAB9AALDH1A1
SCHEMBL25682598 0.81 ALKBH5 (0.44) GPR3MAPTHPGDALDH1A1SMN1; SMN2
SCHEMBL2388003 0.80 GPR3 (0.56) GPR3MAPTHPGDRAB9AALDH1A1
SCHEMBL25682594 0.78 ALKBH5 (0.44) GPR3MAPTHPGDALDH1A1SMN1; SMN2
SCHEMBL20650931 0.78 CA2 (0.44) GPR3MAPTRAB9AALDH1A1MEN1
SCHEMBL13183686 0.78 ALKBH5 (0.49) GPR3MAPTHPGDRAB9AALDH1A1
SCHEMBL25681857 0.78 F9 (0.39) GPR3MAPTHPGDRAB9AALDH1A1
SCHEMBL25682549 0.77 KIF11 (0.38) GPR3MAPTHPGDRAB9AALDH1A1

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-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

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 1535/4885MAPT 1225/4885HPGD 1840/4885

“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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