SCHEMBL788554

SCHEMBL788554

Cc1cc(C)c(-c2ccc3sc4c(-c5ccc6[nH]c7ccc(-c8cc(-c9c(C)cc(C)cc9C)cc9c8sc8ccc(-c%10c(C)cc(C)cc%10C)cc89)cc7c6c5)cc(-c5c(C)cc(C)cc5C)cc4c3c2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
TLR9 Q9NR96 1/20 0.32
TLR8 Q9NR97 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
GRIA1 P42261 1/20 0.31
CACNG8 Q8WXS5 1/20 0.31
CHEK1 O14757 1/20 0.31
WEE1 P30291 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TNKS O95271 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
SCHEMBL786994 0.94 KIF11 (0.37) PIM1PIM2KDM4EMEN1NPC1
SCHEMBL10227371 0.85 RAB9A (0.35) PIM1PIM2CHEK1WEE1KDM4E
SCHEMBL788687 0.84 KIF11 (0.41) PIM1PIM2KDM4EMEN1NPC1
SCHEMBL10226925 0.81 ALOX5 (0.51) PIM1PIM2GRIA1CACNG8MEN1
SCHEMBL30467082 0.80 GRIA1 (0.43) GRIA1CACNG8KDM4EMEN1NPC1
SCHEMBL12264378 0.80 GRIA1 (0.43) GRIA1CACNG8KDM4EMEN1NPC1
SCHEMBL787124 0.80 KIF11 (0.42) PIM1PIM2KDM4EMEN1NPC1
SCHEMBL8281367 0.79 SMN1; SMN2 (0.39) KDM4EMEN1NPC1ALDH1A1HPGD
SCHEMBL10227106 0.79 KIF11 (0.47) KDM4EMEN1NPC1ALDH1A1LMNA
SCHEMBL4549335 0.78 CYP1A2 (0.37) PIM1PIM2MEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140145175-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-05-29 US disclosed
US-8642782-B2 Carbazole derivative, light-emitting element material and organic semiconductor material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-02-04 US disclosed
US-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-22 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-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SLC39A3, SULT1A1, NUTF2 PIM1 3603/4885PIM2 3428/4885TLR9 3566/4885

“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.