SCHEMBL12286162

SCHEMBL12286162

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4sc5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5c4c3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.49
PIM3 Q86V86 2/20 0.47
GPR3 P46089 1/20 0.42
ROCK1 Q13464 1/20 0.42
F9 P00740 2/20 0.42
PIK3CA P42336 1/20 0.42
PI4KA P42356 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 1/20 0.39
JAK2 O60674 1/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
TRIM58 Q8NG06 1/20 0.39
MEN1 O00255 1/20 0.38
ESR1 P03372 1/20 0.38
KMT2A Q03164 1/20 0.38
MAP4K4 O95819 1/20 0.38
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38

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
SCHEMBL14410442 1.00 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL13979477 1.00 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL16582666 1.00 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL14410436 0.98 LIMK1 (0.47) LIMK1PIM3GPR3ROCK1F9
SCHEMBL13979506 0.98 LIMK1 (0.47) LIMK1PIM3GPR3ROCK1F9
SCHEMBL17057278 0.96 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL17320263 0.96 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL13979503 0.96 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL14739297 0.96 LIMK1 (0.49) LIMK1PIM3GPR3ROCK1F9
SCHEMBL29828944 0.96 LIMK1 (0.51) LIMK1PIM3GPR3ROCK1F9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3044286-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2018-01-31 EP disclosed
US-20160226001-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2016-08-04 US disclosed
US-20160226001-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2016-08-04 US disclosed
US-8987715-B2 Organic electroluminescence element IDEMITSU KOSAN CO., LTD. (JP) 2015-03-24 US disclosed
US-8987715-B2 Organic electroluminescence element IDEMITSU KOSAN CO., LTD. (JP) 2015-03-24 US disclosed
US-20130092913-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO.,LTD. 2013-04-18 US disclosed
US-20130092913-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO.,LTD. 2013-04-18 US disclosed
US-20130075716-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU LOSAN CO LTD (JP) 2013-03-28 US disclosed
US-20130075716-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU LOSAN CO LTD (JP) 2013-03-28 US disclosed
US-20130037788-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-14 US disclosed
US-20130037788-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-02-14 US disclosed
WO-2011132624-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-27 WO disclosed
EP-2001064-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SUCH MATERIAL Idemitsu Kosan Co., Ltd. (JP) 2008-12-10 EP disclosed
US-20070224446-A1 Material for organic electroluminescence device and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2007-09-27 US disclosed
US-20070224446-A1 Material for organic electroluminescence device and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2007-09-27 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-20130037788-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME TPMT, TPT1, TRMT1L LIMK1 268/4885PIM3 384/4885GPR3 2207/4885

“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.