SCHEMBL25818655

SCHEMBL25818655

CC(C)(C)c1ccccc1-c1ccc(OBO)cc1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.36
▸ TSHR P16473 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ESRRA P11474 2/20 0.34
▸ CA2 P00918 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ LPAR1 Q92633 1/20 0.33
▸ TRPA1 O75762 1/20 0.33
▸ PDK2 Q15119 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ PLA2G1B P04054 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SENP8 Q96LD8 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31

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
SCHEMBL11020611 0.72 ALDH1A1 (0.50) ALDH1A1TSHRTDP1CA2MAPT
SCHEMBL1194484 0.72 ALDH1A1 (0.55) ALDH1A1TSHRTDP1CA2MAPT
SCHEMBL545684 0.70 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2MAPT
Phosphine SCHEMBL2238711 0.70 ALDH1A1 (0.52) ALDH1A1TSHRTDP1CA2MAPT
SCHEMBL14211028 0.70 ALDH1A1 (0.45) ALDH1A1TSHRTDP1CA2MAPT
SCHEMBL17298431 0.70 CA2 (0.61) ALDH1A1TSHRTDP1CA2POLB
SCHEMBL16259713 0.70 CA2 (0.41) ALDH1A1ESRRACA2POLBMAPT
SCHEMBL5546106 0.69 CA1 (0.54) ALDH1A1TSHRCA2MAPTCA1
SCHEMBL9254216 0.69 CYP1A1 (0.53) ALDH1A1TDP1CA2MAPTCA1
SCHEMBL25818592 0.68 BACE1 (0.38) ALDH1A1MAPTNPC1RAB9AL3MBTL1

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-11917914-B1 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2024-02-27 — — US disclosed
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-07-13 — — 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-11917914-B1 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof NFE2L2, ESR1, OR51E2 ALDH1A1 1010/4885TSHR 4284/4885TDP1 2171/4885
US-20230225206-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF NFE2L2, ESR1, OR51E2 ALDH1A1 1010/4885TSHR 4284/4885TDP1 2171/4885

“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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