SCHEMBL22079682

SCHEMBL22079682

Cc1cc(C)cc(-c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4-c4ccccc4)cc3)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPRT1 P00492 1/20 0.38
PTGS2 P35354 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38

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
SCHEMBL22079950 1.00 MAPT (0.39) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998835 0.92 CYP1A2 (0.36) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998839 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998851 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998824 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998816 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998840 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL19998858 0.89 RXRA (0.47) MAPTL3MBTL1CYP1A2KDM4EALDH1A1
SCHEMBL22079559 0.88 ENPP3 (0.48) MAPTL3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL22079954 0.87 HPRT1 (0.45) MAPTL3MBTL1CYP1A2KDM4EALDH1A1

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-11605780-B2 Compound, light-emitting element containing the same, display device, and lighting device TORAY INDUSTRIES, INC. (JP) 2023-03-14 US disclosed
US-20200185612-A1 COMPOUND, LIGHT-EMITTING ELEMENT CONTAINING THE SAME, DISPLAY DEVICE, AND LIGHTING DEVICE TORAY INDUSTRIES, INC. (JP) 2020-06-11 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-11605780-B2 Compound, light-emitting element containing the same, display device, and lighting device NR2E3, PER2, CRY2 MAPT 956/4885L3MBTL1 1746/4885CYP1A2 342/4885
US-20200185612-A1 COMPOUND, LIGHT-EMITTING ELEMENT CONTAINING THE SAME, DISPLAY DEVICE, AND LIGHTING DEVICE NR2E3, PER2, CRY2 MAPT 956/4885L3MBTL1 1746/4885CYP1A2 342/4885

“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.