SCHEMBL552038

SCHEMBL552038

CCCCCCCCc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(CCCCCCCC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORA P35398 1/20 0.48
RORC P51449 1/20 0.48
RORB Q92753 1/20 0.48
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
KDM4E B2RXH2 2/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
HTR2A P28223 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL18858863 1.00 RORA (0.48) RORARORCRORBFAAHMGLL
SCHEMBL14107128 1.00 RORA (0.48) RORARORCRORBFAAHMGLL
SCHEMBL15385939 0.96 RORA (0.47) RORARORCRORBFAAHMGLL
SCHEMBL17248306 0.94 KDM4E (0.46) RORARORCRORBFAAHMGLL
SCHEMBL15165490 0.94 MGLL (0.50) RORARORCRORBFAAHMGLL
SCHEMBL9901489 0.91 RORA (0.42) RORARORCRORBFAAHMGLL
SCHEMBL9901161 0.90 HSD11B1 (0.42) RORARORCRORBFAAHMGLL
SCHEMBL25297485 0.88 RORA (0.46) RORARORCRORBFAAHMGLL
SCHEMBL25785325 0.88 RORA (0.46) RORARORCRORBFAAHMGLL
SCHEMBL14325105 0.88 RORA (0.46) RORARORCRORBFAAHMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714253-B2 Organic thin film transistor, organic semiconductor thin film, and organic semiconductor material FUJIFILM CORPORATION (JP) 2017-07-25 US disclosed
US-20150166561-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2015-06-18 US disclosed
US-20140088313-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2014-03-27 US disclosed
US-20140088313-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2014-03-27 US disclosed
US-8609867-B2 Substituted indolocarbazoles XEROX CORPORATION (US) 2013-12-17 US disclosed
US-20130320269-A1 PROCESS FOR THE PREPARATION OF SEMICONDUCTOR MATERIALS, COMPOUNDS AND THEIR USE THE UNIVERSITY OF MANCHESTER (GB) 2013-12-05 US disclosed
EP-2649073-A2 PROCESS FOR THE PREPARATION OF SEMICONDUCTOR MATERIALS, COMPOUNDS AND THEIR USE The University Of Manchester (GB) 2013-10-16 EP disclosed
EP-1671998-B1 Process to form compound with indolocarbazole moieties XEROX CORP (US) 2013-02-20 EP disclosed
US-20120157689-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2012-06-21 US disclosed
US-20120157689-A1 SUBSTITUTED INDOLOCARBAZOLES XEROX CORPORATION (US) 2012-06-21 US disclosed
US-7402681-B2 Compound with indolocarbazole moieties and devices containing such compound XEROX CORPORATION (US) 2008-07-22 US disclosed
US-7173140-B2 Process to form compound with indolocarbazole moieties XEROX CORPORATION (US) 2007-02-06 US disclosed
US-7173140-B2 Process to form compound with indolocarbazole moieties XEROX CORPORATION (US) 2007-02-06 US disclosed
US-20060214155-A1 Compound with indolocarbazole moieties and devices containing such compound XEROX CORPORATION 2006-09-28 US disclosed
EP-1672713-A1 Compound with indolocarbazole moieties and electronic devices containing such compound Xerox Corporation (US) 2006-06-21 EP disclosed
EP-1671998-A2 Process to form compound with indolocarbazole moieties Xerox Corporation (US) 2006-06-21 EP disclosed
US-20060124923-A1 Thin film transistors including indolocarbazoles XEROX CORPORATION 2006-06-15 US disclosed
US-20060124921-A1 Compound with indolocarbazole moieties and devices containing such compound XEROX CORPORATION (US) 2006-06-15 US disclosed
US-20060125009-A1 Thin film transistors including indolocarbazoles XEROX CORPORATION 2006-06-15 US disclosed
US-20060128969-A1 Process to form compound with indolocarbazole moieties XEROX CORPORATION 2006-06-15 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 (5 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-20150166561-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL TRMT1L, APOL1, TLL1 RORA 3919/4885RORC 4262/4885RORB 4218/4885
US-20060128969-A1 Process to form compound with indolocarbazole moieties INMT, CYP3A4, PLK1 RORA 1281/4885RORC 497/4885RORB 1172/4885
US-20060214155-A1 Compound with indolocarbazole moieties and devices containing such compound BRD4, INO80C, BICRA RORA 1210/4885RORC 383/4885RORB 982/4885
US-20060124921-A1 Compound with indolocarbazole moieties and devices containing such compound BRD4, INO80C, BICRA RORA 1210/4885RORC 383/4885RORB 982/4885
US-20120157689-A1 SUBSTITUTED INDOLOCARBAZOLES HTR3C, HTR3A, AANAT RORA 577/4885RORC 241/4885RORB 424/4885

“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.