SCHEMBL81166

SCHEMBL81166

CC1(C)c2ccccc2-c2nc(-c3cc(-c4ccccc4)nc4ccccc34)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 3/20 0.45
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 4/20 0.43
ACHE P22303 2/20 0.42
KDM4E B2RXH2 4/20 0.40
PDE10A Q9Y233 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
DHODH Q02127 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
MAPK1 P28482 2/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TOP1 P11387 1/20 0.37
HTT P42858 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL80745 0.86 ACACA (0.35) ACACALMNAHPGDKDM4EALDH1A1
SCHEMBL81165 0.85 KMT2A (0.41) LMNASMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL81932 0.84 ALDH1A1 (0.33) ACACAHPGDKDM4EALDH1A1MAPT
SCHEMBL81054 0.82 KMT2A (0.34) KDM4ECYP2C9ALDH1A1MAPTHSD17B10
SCHEMBL80884 0.82 KMT2A (0.38) LMNASMN1; SMN2HPGDKDM4EL3MBTL1
SCHEMBL80224 0.81 ALDH1A1 (0.36) HPGDKDM4EL3MBTL1ALDH1A1MAPK1
SCHEMBL80742 0.81 KMT2A (0.35) SMN1; SMN2KDM4EALDH1A1MAPTMEN1
SCHEMBL81115 0.81 KDM4E (0.33) HPGDKDM4EALDH1A1MAPK1KMT2A
SCHEMBL80800 0.80 KMT2A (0.36) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL80354 0.80 KMT2A (0.36) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129899-B1 Azafluorene derivative and organic light-emitting device using the derivative CANON KABUSHIKI KAISHA (JP) 2012-03-06 US disclosed
US-8129899-B1 Azafluorene derivative and organic light-emitting device using the derivative CANON KABUSHIKI KAISHA (JP) 2012-03-06 US disclosed
US-20120049176-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-20120049176-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-8110685-B2 Efficient, durable electron transport layers; low driving voltage; simple, low cost production CANON KABUSHIKI KAISHA (JP) 2012-02-07 US disclosed
US-8110685-B2 Efficient, durable electron transport layers; low driving voltage; simple, low cost production CANON KABUSHIKI KAISHA (JP) 2012-02-07 US disclosed
US-20080154040-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 2008-06-26 US disclosed
US-20080154040-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 2008-06-26 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-20080154040-A1 AZAFLUORENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING THE DERIVATIVE AZI2, CYP1A2, CYP2C19 ACACA 2650/4885LMNA 3313/4885SMN1; SMN2 4373/4885

“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.