SCHEMBL10015399

SCHEMBL10015399

Cc1cc(-c2c3cc4c5ccccc5c5cccc(c3c(-c3cc(C)nc(C)c3)c3c6cccc7c(-c8ccccc8)ccc(c23)c76)c54)cc(C)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 2/20 0.35
▸ ADORA2A P29274 4/20 0.33
▸ ADORA1 P30542 2/20 0.32
▸ ADORA2B P29275 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ MAPT P10636 3/20 0.31
▸ RAB9A P51151 3/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ NCF1 P14598 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 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
SCHEMBL14700561 0.89 CRHR1 (0.32) CRHR1
SCHEMBL13090403 0.85 CYP1A2 (0.38) ADORA2AADORA1ADORA2BCYP1A2KDM4E
SCHEMBL10015419 0.81 MEN1 (0.35) ADORA2AADORA1CYP1A2KDM4EALDH1A1
SCHEMBL14139825 0.78 KDM4E (0.34) ADORA2AADORA1KDM4EALDH1A1HPGD
SCHEMBL14139827 0.78 KDM4E (0.34) ADORA2AADORA1KDM4EALDH1A1HPGD
SCHEMBL14139948 0.78 ALDH1A1 (0.38) ADORA2ACYP1A2KDM4EALDH1A1HPGD
SCHEMBL14139947 0.78 ALDH1A1 (0.38) ADORA2ACYP1A2KDM4EALDH1A1HPGD
SCHEMBL14139986 0.77 HSD17B1 (0.41) ADORA1CYP1A2MEN1KMT2A
SCHEMBL14139988 0.77 HSD17B1 (0.41) ADORA1CYP1A2MEN1KMT2A
SCHEMBL25005766 0.76 MEN1 (0.36) CYP1A2RAB9AMEN1KMT2A

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 9 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-9315460-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2016-04-19 — — US disclosed
US-9315460-B2 Organic compound, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2016-04-19 — — US disclosed
US-8940413-B2 Organic compound having acenaphtho[1,2-k]benzo[e]acephenanthrene derivative, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2015-01-27 — — US disclosed
US-8940413-B2 Organic compound having acenaphtho[1,2-k]benzo[e]acephenanthrene derivative, light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2015-01-27 — — US disclosed
US-20140374738-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KK (JP) 2014-12-25 — — US disclosed
US-20140374738-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KK (JP) 2014-12-25 — — US disclosed
US-20120025183-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-02-02 — — US disclosed
US-20120025183-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-02-02 — — 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-20120025183-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS ACE, ACE2, AGTR1 CRHR1 616/4885ADORA2A 1440/4885ADORA1 731/4885

“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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