SCHEMBL4745943

SCHEMBL4745943

Cc1ccc2c(c1)c(-c1ccc3c4c1ccc1ccc5cccc-3c5c14)cc1c3ccc(C)c4c3c(cc21)-c1ncccc1-4

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL4745941 0.94 ALDH1A1 (0.36) ALDH1A1CYP1A2CYP2A6CCR1CCR5
SCHEMBL4745959 0.89 CYP1A2 (0.35) ALDH1A1CYP1A2CYP2A6CCR1CCR5
SCHEMBL4745880 0.89 MAPT (0.34) ALDH1A1L3MBTL1
SCHEMBL4746394 0.88 MEN1 (0.32) ALDH1A1CYP1A2CCR1CCR8
SCHEMBL4745860 0.88 MAOA (0.35) ALDH1A1CYP1A2CYP2A6CCR1CCR8
SCHEMBL4746409 0.87 PDK2 (0.33) ALDH1A1CYP1A2CCR1CCR8L3MBTL1
SCHEMBL4745945 0.86 HPRT1 (0.37) ALDH1A1CYP1A2CYP2A6CCR1CCR5
SCHEMBL4746108 0.85 CCR1 (0.39) ALDH1A1CYP1A2CCR1CCR5CCR8
SCHEMBL4746272 0.85 MAPT (0.32) CCR1CCR8
SCHEMBL4745912 0.85 TGFBR1 (0.31)

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-8173275-B2 Azaindenochrysene derivative and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2012-05-08 US disclosed
US-8173275-B2 Azaindenochrysene derivative and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2012-05-08 US disclosed
US-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-05-13 US disclosed
US-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2010-05-13 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 (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-20100117526-A1 NOVEL AZAINDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE NR2E3, OR51E2, AZI2 ALDH1A1 179/4885CYP1A2 56/4885CYP2A6 167/4885

“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.