SCHEMBL1687985

SCHEMBL1687985

c1ccc(-c2ccc3sc4c(-c5cccc(-c6ccc7c8ccccc8c8ccccc8c7c6)c5)cc(-c5ccccc5)cc4c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.43
ALOX5 P09917 1/20 0.43
PIM3 Q86V86 3/20 0.39
TNKS O95271 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
MAP3K8 P41279 5/20 0.36
PIM1 P11309 3/20 0.36
PIM2 Q9P1W9 2/20 0.36
F9 P00740 3/20 0.35
MAPK1 P28482 1/20 0.33
MAP2K1 Q02750 1/20 0.33
ROCK1 Q13464 1/20 0.33
PRKDC P78527 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33

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
SCHEMBL24606382 0.99 LIMK1 (0.44) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL15179507 0.97 LIMK1 (0.45) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL17263361 0.94 ALOX5 (0.49) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL17057214 0.94 ALOX5 (0.49) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL25140418 0.94 ALOX5 (0.49) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL17057219 0.94 ALOX5 (0.49) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL30258311 0.94 LIMK1 (0.47) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL22214880 0.94 ALOX5 (0.47) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL22419981 0.92 ALOX5 (0.48) LIMK1ALOX5PIM3TNKSTNKS2
SCHEMBL17057224 0.91 ALOX5 (0.49) LIMK1ALOX5PIM3TNKSTNKS2

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3120396-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2021-06-02 EP disclosed
US-20210151694-A1 Composite Material, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-05-20 US disclosed
US-10374171-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-08-06 US disclosed
US-9997727-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-9997727-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-9907140-B2 Organic electroluminescent element UDC IRELAND LIMITED (IE) 2018-02-27 US disclosed
US-9907140-B2 Organic electroluminescent element UDC IRELAND LIMITED (IE) 2018-02-27 US disclosed
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-04-27 US disclosed
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-04-27 US disclosed
US-20170092875-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2017-03-30 US disclosed
US-20130112952-A1 DEPOSITING PREMIXED MATERIALS NIPPON STEEL CHEMICAL CO., LTD. (JP) 2013-05-09 US disclosed
US-20130112952-A1 DEPOSITING PREMIXED MATERIALS NIPPON STEEL CHEMICAL CO., LTD. (JP) 2013-05-09 US disclosed
US-8367850-B2 Benzo-fused thiophene or benzo-fused furan compounds comprising a triphenylene group UNIVERSAL DISPLAY CORPORATION (US) 2013-02-05 US disclosed
US-8367850-B2 Benzo-fused thiophene or benzo-fused furan compounds comprising a triphenylene group UNIVERSAL DISPLAY CORPORATION (US) 2013-02-05 US disclosed
WO-2012046560-A1 COMPOSITE MATERIAL, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-04-12 WO disclosed
US-20120080667-A1 COMPOSITE MATERIAL, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-04-05 US disclosed
US-20120080667-A1 COMPOSITE MATERIAL, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-04-05 US disclosed
WO-2011136755-A1 DEPOSITING PREMIXED MATERIALS UNIVERSAL DISPLAY CORPORATION (US) 2011-11-03 WO disclosed
US-20100237334-A1 Benzo-Fused Thiophene or Bezon-Fused Furan Compounds Comprising a Triphenylene Group UNIVERSAL DISPLAY CORPORATION (US) 2010-09-23 US disclosed
US-20100237334-A1 Benzo-Fused Thiophene or Bezon-Fused Furan Compounds Comprising a Triphenylene Group UNIVERSAL DISPLAY CORPORATION (US) 2010-09-23 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 (4 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-20130112952-A1 DEPOSITING PREMIXED MATERIALS MCM4, MCM2, MCM5 LIMK1 2792/4885ALOX5 1810/4885PIM3 4438/4885
US-20100237334-A1 Benzo-Fused Thiophene or Bezon-Fused Furan Compounds Comprising a Triphenylene Group TFEB, BRD4, TEC LIMK1 2156/4885ALOX5 1734/4885PIM3 356/4885
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES TPR, EED, TEC LIMK1 232/4885ALOX5 2467/4885PIM3 245/4885
US-10374171-B2 Organic electroluminescent materials and devices TPR, EED, TEAD2 LIMK1 457/4885ALOX5 1768/4885PIM3 496/4885

“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.