SCHEMBL25112944

SCHEMBL25112944

c1ccc2c(-c3cc4cccc5c6ccccc6c6ccccc6c6cccc3c6c45)c3ccccc3c(-c3cn4ccccc4n3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 13/20 0.48
▸ NPC1 O15118 12/20 0.48
▸ ALDH1A1 P00352 9/20 0.48
▸ PKM P14618 5/20 0.48
▸ MAPT P10636 4/20 0.48
▸ LMNA P02545 1/20 0.48
▸ KDM4E B2RXH2 12/20 0.45
▸ SMN1; SMN2 Q16637 6/20 0.45
▸ POLB P06746 3/20 0.45
▸ GFER P55789 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ MIF P14174 1/20 0.41
▸ TLR9 Q9NR96 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL25112904 0.87 RAB9A (0.44) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25112929 0.82 ALDH1A1 (0.51) RAB9ANPC1ALDH1A1MAPTLMNA
SCHEMBL25112786 0.81 RAB9A (0.51) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25112941 0.80 RAB9A (0.44) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL972785 0.79 RAB9A (0.55) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25112906 0.77 RAB9A (0.49) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL13454263 0.75 RAB9A (0.53) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25112863 0.75 RAB9A (0.50) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL25112966 0.74 RAB9A (0.50) RAB9ANPC1ALDH1A1PKMMAPT
SCHEMBL9976894 0.74 RAB9A (0.50) RAB9ANPC1ALDH1A1PKMMAPT

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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 — — 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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 RAB9A 1606/4885NPC1 2399/4885ALDH1A1 192/4885

“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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