SCHEMBL80745

SCHEMBL80745

CC1(C)c2ccccc2-c2nc(-c3cc4c5ccccc5c(-c5ccccc5)cc4c4ccccc34)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 3/20 0.35
KDM4E B2RXH2 4/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 1/20 0.32
MPI P34949 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
PSMB5 P28074 1/20 0.31
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
RXRA P19793 1/20 0.30
SQOR Q9Y6N5 1/20 0.30

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
SCHEMBL81932 0.88 ALDH1A1 (0.33) ACACAKDM4EKMT2AMEN1ALDH1A1
SCHEMBL80227 0.87 HPRT1 (0.37) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL81054 0.86 KMT2A (0.34) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL81166 0.86 ACACA (0.45) ACACAKDM4EKMT2AMEN1ALDH1A1
SCHEMBL80224 0.85 ALDH1A1 (0.36) KDM4EKMT2AALDH1A1HPGDCYP11B1
SCHEMBL13320361 0.85 ALDH1A1 (0.41) ALDH1A1HPGD
SCHEMBL81481 0.84 KMT2A (0.32) KMT2ARARB
SCHEMBL80742 0.82 KMT2A (0.35) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL81115 0.82 KDM4E (0.33) KDM4EKMT2AALDH1A1HPGD
SCHEMBL81926 0.82 CYP11B1 (0.38) KMT2AALDH1A1HPGDCYP11B1

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 6 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-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 2650/4885KDM4E 852/4885KMT2A 699/4885

“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.