SCHEMBL12731446

SCHEMBL12731446

CC1(C)c2ccccc2-c2c1cc1ccc3c(-c4ccc(-c5cn6cccnc6n5)cc4)ccc4ccc2c1c43

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.47
▸ KDM4E B2RXH2 12/20 0.47
▸ RAB9A P51151 12/20 0.47
▸ NPC1 O15118 9/20 0.47
▸ GAA P10253 8/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ HPGD P15428 7/20 0.46
▸ GLA P06280 6/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ SMN1; SMN2 Q16637 7/20 0.44
▸ POLB P06746 2/20 0.44
▸ MAPT P10636 5/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP1A2 P05177 1/20 0.41
▸ GFER P55789 1/20 0.40
▸ CDC7 O00311 1/20 0.39
▸ DAPK3 O43293 1/20 0.39
▸ DYRK3 O43781 1/20 0.39
▸ ROCK2 O75116 1/20 0.39

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
SCHEMBL12731457 0.88 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL12731445 0.86 RAB9A (0.43) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL15803096 0.84 ALDH1A1 (0.46) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL16622282 0.83 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821075 0.81 ALDH1A1 (0.41) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL4469310 0.80 ALDH1A1 (0.58) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821060 0.78 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821066 0.77 ALDH1A1 (0.48) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821079 0.77 ALDH1A1 (0.50) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821052 0.77 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ANPC1GAA

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-9000420-B2 Condensed-cyclic compound and organic light emitting diode including organic layer containing the condensed-cyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-07 — — US disclosed
US-9000420-B2 Condensed-cyclic compound and organic light emitting diode including organic layer containing the condensed-cyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-07 — — US disclosed
US-20110084256-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING ORGANIC LAYER CONTAINING THE CONDENSED-CYCLIC COMPOUND SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2011-04-14 — — US disclosed
US-20110084256-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING ORGANIC LAYER CONTAINING THE CONDENSED-CYCLIC COMPOUND SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2011-04-14 — — US disclosed
EP-2308843-A1 Condensed-cyclic compound and organic light emitting diode including organic layer containing the condensed-cyclic compound Samsung Mobile Display Co., Ltd. (KR) 2011-04-13 — — 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-20110084256-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE INCLUDING ORGANIC LAYER CONTAINING THE CONDENSED-CYCLIC COMPOUND CCNL2, C9, OCIAD1 ALDH1A1 417/4885KDM4E 3667/4885RAB9A 2522/4885

“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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