SCHEMBL12776974

SCHEMBL12776974

Cc1ccc(-c2cc(-c3ccc(C)cc3)c3ccc4c(-c5nc6ccccc6o5)cc(-c5ccc(C)cc5)c5ccc2c3c54)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.57
▸ HPGD P15428 8/20 0.57
▸ ALDH1A1 P00352 8/20 0.57
▸ MAPT P10636 4/20 0.57
▸ USP2 O75604 2/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ PTGS2 P35354 3/20 0.49
▸ NPC1 O15118 11/20 0.49
▸ RAB9A P51151 9/20 0.49
▸ SMN1; SMN2 Q16637 8/20 0.49
▸ HSD17B10 Q99714 5/20 0.49
▸ TP53 P04637 4/20 0.49
▸ CASP3 P42574 2/20 0.48
▸ SENP8 Q96LD8 2/20 0.48
▸ SENP7 Q9BQF6 2/20 0.48
▸ SENP6 Q9GZR1 2/20 0.48
▸ HCRTR1 O43613 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL12776918 1.00 KDM4E (0.57) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL2296437 0.94 KDM4E (0.51) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12776901 0.89 KDM4E (0.57) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12776908 0.89 ALDH1A1 (0.58) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12777003 0.88 NPC1 (0.56) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12777005 0.88 KDM4E (0.66) KDM4EHPGDALDH1A1MAPTTDP1
SCHEMBL12777012 0.87 KDM4E (0.46) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12776940 0.87 ALDH1A1 (0.62) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL20058290 0.87 ALDH1A1 (0.45) KDM4EHPGDALDH1A1MAPTUSP2
SCHEMBL12776975 0.86 KDM4E (0.50) KDM4EHPGDALDH1A1MAPTUSP2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7901794-B2 Material for light-emitting element and light emitting element TORAY INDUSTRIES, INC. (JP) 2011-03-08 — — US disclosed
US-7901794-B2 Material for light-emitting element and light emitting element TORAY INDUSTRIES, INC. (JP) 2011-03-08 — — US disclosed
US-20090066245-A1 MATERIAL FOR LIGHT-EMITTING ELEMENT AND LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2009-03-12 — — US disclosed
US-20090066245-A1 MATERIAL FOR LIGHT-EMITTING ELEMENT AND LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2009-03-12 — — 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-20090066245-A1 MATERIAL FOR LIGHT-EMITTING ELEMENT AND LIGHT EMITTING ELEMENT PYM1, CRY1, S100A10 KDM4E 1639/4885HPGD 2445/4885ALDH1A1 2046/4885

“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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