SCHEMBL25993502

SCHEMBL25993502

Cn1c2cccc(C(C)(C)C)c2c2c3c(ccc21)sc1ccccc13

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 2/20 0.38
▸ DUSP3 P51452 2/20 0.36
▸ PTPN7 P35236 1/20 0.36
▸ PTPN12 Q05209 1/20 0.36
▸ PTPN22 Q9Y2R2 1/20 0.36
▸ MAPT P10636 9/20 0.35
▸ HTT P42858 2/20 0.35
▸ RAB9A P51151 4/20 0.35
▸ HPGD P15428 3/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ HSD17B10 Q99714 2/20 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
SCHEMBL25993503 0.86 GPR3 (0.40) GPR3DUSP3PTPN7PTPN12PTPN22
SCHEMBL25682736 0.85 GPR3 (0.37) GPR3DUSP3PTPN7PTPN12PTPN22
SCHEMBL25682550 0.84 GPR3 (0.36) GPR3DUSP3PTPN7PTPN12PTPN22
SCHEMBL25682451 0.84 GPR3 (0.36) GPR3MAPTHTTRAB9AHPGD
SCHEMBL25682427 0.83 GPR3 (0.39) GPR3MAPTHTTRAB9AHPGD
SCHEMBL2388003 0.82 GPR3 (0.56) GPR3DUSP3PTPN7PTPN12PTPN22
SCHEMBL25993506 0.81 GPR3 (0.40) GPR3MAPTHTTHPGDMEN1
SCHEMBL13183674 0.81 GPR3 (0.48) GPR3DUSP3MAPTHTTRAB9A
SCHEMBL25993499 0.80 GPR3 (0.37) GPR3DUSP3PTPN7PTPN12PTPN22
SCHEMBL25682515 0.80 GPR3 (0.37) GPR3DUSP3PTPN7PTPN12PTPN22

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 1535/4885DUSP3 4877/4885PTPN7 4862/4885

“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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