SCHEMBL13090403

SCHEMBL13090403

Cc1cc(-c2c3cc4c5ccccc5c5cccc(c3c(-c3cc(C)nc(C)c3)c3c6cccc7cccc(c23)c76)c54)cc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.38
▸ HSD17B10 Q99714 4/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HPGD P15428 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ LMNA P02545 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ NCF1 P14598 1/20 0.31
▸ ADORA2A P29274 2/20 0.31
▸ MAT2A P31153 1/20 0.30
▸ ADORA2B P29275 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
SCHEMBL10015399 0.85 CRHR1 (0.35) CYP1A2HSD17B10ALDH1A1HPGDLMNA
SCHEMBL503375 0.83 CYP1A2 (0.44) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL14700561 0.82 CRHR1 (0.32) —
SCHEMBL13101555 0.81 CYP1A2 (0.39) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL23348932 0.79 CYP1A2 (0.37) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL13101553 0.78 CYP11B1 (0.49) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL13090464 0.77 ALDH1A1 (0.38) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL17119049 0.76 CA1 (0.38) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL7128292 0.76 ALDH1A1 (0.64) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL22916881 0.75 CYP1A2 (0.39) CYP1A2HSD17B10ALDH1A1HPGDTHRB

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-20190245152-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2019-08-08 — — US disclosed
US-8293384-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2012-10-23 — — US disclosed
US-8293384-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2012-10-23 — — US disclosed
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 — — US disclosed
US-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 — — US disclosed
EP-2243761-A1 Phenanthrene derivatives, light-emitting device and image display apparatus using the same Canon Kabushiki Kaisha (JP) 2010-10-27 — — EP 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-20100270914-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS ACE2, ACE, AGTR1 CYP1A2 50/4885HSD17B10 475/4885ALDH1A1 100/4885

“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.

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