SCHEMBL13821079

SCHEMBL13821079

CC1(C)c2ccccc2-c2cc3c(-c4ccc(-c5cn6cccnc6n5)cc4)c4ccccc4c(-c4ccc(-c5cn6cccnc6n5)cc4)c3cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.50
▸ KDM4E B2RXH2 12/20 0.50
▸ RAB9A P51151 12/20 0.50
▸ NPC1 O15118 9/20 0.50
▸ GAA P10253 8/20 0.50
▸ HPGD P15428 7/20 0.50
▸ GLA P06280 6/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ SMN1; SMN2 Q16637 7/20 0.47
▸ POLB P06746 2/20 0.47
▸ MAPT P10636 5/20 0.47
▸ TP53 P04637 1/20 0.47
▸ GFER P55789 1/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ CDC7 O00311 1/20 0.41
▸ DAPK3 O43293 1/20 0.41
▸ DYRK3 O43781 1/20 0.41
▸ ROCK2 O75116 1/20 0.41

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
SCHEMBL13821066 0.98 ALDH1A1 (0.48) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821061 0.97 ALDH1A1 (0.53) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821052 0.95 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821073 0.94 ALDH1A1 (0.45) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821067 0.94 ALDH1A1 (0.44) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821055 0.93 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821054 0.93 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821060 0.92 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821048 0.92 ALDH1A1 (0.54) ALDH1A1KDM4ERAB9ANPC1GAA
SCHEMBL13821045 0.92 ALDH1A1 (0.54) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012042-B2 Condensed-cyclic compound, organic light-emitting device comprising the same, and flat panel display apparatus SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-21 — — US disclosed
US-9012042-B2 Condensed-cyclic compound, organic light-emitting device comprising the same, and flat panel display apparatus SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-21 — — US disclosed
US-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-11-15 — — US disclosed
US-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-11-15 — — 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-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS OR10J3, AR, ARL1 ALDH1A1 578/4885KDM4E 2875/4885RAB9A 1129/4885

“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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