SCHEMBL17487145

SCHEMBL17487145

Cc1cc(C#N)ccc1-c1c2cc3c(cc2c(-c2ccc(C#N)cc2C)c2c4cc5ccccc5c5cccc(c12)c54)c1cccc2c4ccccc4cc3c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
EGLN2 Q96KS0 4/20 0.36
CYP1A2 P05177 5/20 0.35
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 3/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 2/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
HIF1A Q16665 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP19A1 P11511 1/20 0.33
S1PR1 P21453 1/20 0.31
STK10 O94804 1/20 0.31
SLK Q9H2G2 1/20 0.31
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 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
SCHEMBL17487146 1.00 CA1 (0.39) CA1CA2EGLN2CYP1A2ALDH1A1
SCHEMBL17490285 0.91 CA1 (0.39) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL17490298 0.91 CA1 (0.39) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL23349021 0.86 CA1 (0.36) CA1CA2EGLN2CYP1A2ALDH1A1
SCHEMBL25642001 0.83 CYP1A2 (0.36) CA1CA2EGLN2CYP1A2ALDH1A1
SCHEMBL17487135 0.81 CA1 (0.40) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL17487130 0.81 CA1 (0.40) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL22824243 0.81 ALDH1A1 (0.34) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL17490269 0.80 CYP1A2 (0.41) CA1CA2CYP1A2ALDH1A1HSD17B10
SCHEMBL17490270 0.80 CYP1A2 (0.41) CA1CA2CYP1A2ALDH1A1HSD17B10

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-9472766-B2 Fused polycyclic compound and organic light emitting element including the same CANON KABUSHIKI KAISHA (JP) 2016-10-18 US disclosed
US-9472766-B2 Fused polycyclic compound and organic light emitting element including the same CANON KABUSHIKI KAISHA (JP) 2016-10-18 US disclosed
US-20160035982-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2016-02-04 US disclosed
US-20160035982-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2016-02-04 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-20160035982-A1 NOVEL FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING THE SAME NR2E3, PUF60, CRY2 CA1 2115/4885CA2 2411/4885EGLN2 2453/4885

“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.