SCHEMBL9976736

SCHEMBL9976736

Cc1ccc2c(-c3cc4ccccc4c4ccccc34)cc3c(cc(-c4cc5ccccc5c5ccccc45)c4ccc(C)nc43)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.46
CYP11B1 P15538 1/20 0.40
HPRT1 P00492 1/20 0.39
NISCH Q9Y2I1 1/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 3/20 0.38
HIF1A Q16665 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
CCR1 P32246 1/20 0.38
RAB9A P51151 1/20 0.38
CCR5 P51681 1/20 0.38
CYP1A2 P05177 3/20 0.37
TRPM4 Q8TD43 1/20 0.37
METAP2 P50579 1/20 0.37
CYP1B1 Q16678 1/20 0.36
TP53 P04637 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
SCHEMBL3786280 0.79 CCR1 (0.52) L3MBTL1MAPTHPRT1ALDH1A1CCR1
SCHEMBL30608515 0.77 CCR1 (0.50) L3MBTL1MAPTHPRT1ALDH1A1CCR1
SCHEMBL9976750 0.77 CYP11B1 (0.49) L3MBTL1MAPTCYP11B1HPRT1NISCH
SCHEMBL9976733 0.77 GSTP1 (0.44) L3MBTL1MAPTCYP11B1ALDH1A1HSD17B10
SCHEMBL20313299 0.77 MAOA (0.50) L3MBTL1MAPTALDH1A1CCR1RAB9A
SCHEMBL9976742 0.75 CYP11B1 (0.50) L3MBTL1MAPTCYP11B1NISCHALDH1A1
SCHEMBL4442152 0.74 ALDH1A1 (0.55) L3MBTL1MAPTCYP11B1HPRT1NISCH
SCHEMBL29637136 0.74 ALDH1A1 (0.60) L3MBTL1MAPTCYP11B1HPRT1NISCH
SCHEMBL7905250 0.74 ALDH1A1 (0.60) L3MBTL1MAPTCYP11B1HPRT1NISCH
SCHEMBL6267429 0.74 CCR1 (0.63) L3MBTL1MAPTCCR1RAB9ACCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877354-B2 Heterocyclic compound and organic light-emitting device using the same CANON KABUSHIKI KAISHA (JP) 2014-11-04 US disclosed
US-8877354-B2 Heterocyclic compound and organic light-emitting device using the same CANON KABUSHIKI KAISHA (JP) 2014-11-04 US disclosed
US-20120153270-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-06-21 US disclosed
US-20120153270-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-06-21 US disclosed
WO-2011024391-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-03-03 WO 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-20120153270-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME ORC3, CYP1A1, CRY1 L3MBTL1 1099/4885MAPT 3379/4885CYP11B1 51/4885

“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.