Sugi Predict

Sugi Predict / Compounds / SCHEMBL4400993

SCHEMBL4400993

SCHEMBL4400993

CCN(C)c1ccc(-c2ccc(N(C)CC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 2/20 0.52
▸ ADRA2B P18089 2/20 0.52
▸ ADRA2C P18825 2/20 0.52
▸ HRH3 Q9Y5N1 4/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 5/20 0.38
▸ TSHR P16473 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ IGLV6-57 P01721 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ PSMD14 O00487 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL18323114 1.00 ADRA2A (0.52) ADRA2AADRA2BADRA2CHRH3SMN1; SMN2
SCHEMBL762061 0.93 ALDH1A1 (0.52) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT
SCHEMBL10330355 0.91 ADRA2A (0.58) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT
SCHEMBL10109880 0.91 TAAR1 (0.48) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT
SCHEMBL17524524 0.91 TAAR1 (0.48) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT
SCHEMBL15014147 0.89 ADRA2A (0.44) ADRA2AADRA2BADRA2CMAPTALDH1A1
SCHEMBL762882 0.83 ALDH1A1 (0.61) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT
SCHEMBL11671854 0.83 TSHR (0.46) ADRA2AADRA2BADRA2CHRH3ALDH1A1
SCHEMBL10109879 0.83 TAAR1 (0.42) ADRA2AADRA2BADRA2CMAPTALDH1A1
SCHEMBL8278827 0.81 ALDH1A1 (0.55) ADRA2AADRA2BADRA2CSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102797-B2 Polymers with carbazole structural units MERCK PATENT GMBH (DE) 2015-08-11 — — US disclosed
US-9080099-B2 Fluorine-bridged associations for optoelectronic applications MERCK PATENT GMBH (DE) 2015-07-14 — — US disclosed
US-8637853-B2 Optoelectronic device MERCK PATENT GMBH (DE) 2014-01-28 — — US disclosed
US-20130150527-A1 POLYMERS WITH CARBAZOLE STRUCTURAL UNITS SAMSUNG DISPLAY CO., LTD. (KR) 2013-06-13 — — US disclosed
US-8445630-B2 Polymers BASF SE (DE) 2013-05-21 — — US disclosed
US-8236968-B2 1,4-bis(2-thienylvinyl)benzol derivatives and their use MERCK PATENT GMBH (DE) 2012-08-07 — — US disclosed
US-8221906-B2 Electroluminescent polymers for electronic applications BASF SE (DE) 2012-07-17 — — US disclosed
US-8173276-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2012-05-08 — — US disclosed
US-20110204351-A1 NOVEL DIKETOPYRROLOPYRROLE POLYMERS HEIM INGO 2011-08-25 — — US disclosed
US-7939818-B2 Diketopyrrolopyrrole polymers BASF SE (DE) 2011-05-10 — — US disclosed
US-20090321686-A1 1,4-BIS(2-THIENYLVINYL)BENZOL DERIVATIVES AND THEIR USE BUESING ARNE 2009-12-31 — — US disclosed
US-7638594-B2 Conjugated polymers containing spirobifluorene units and the use thereof MERCK PATENT GMBH (DE) 2009-12-29 — — US disclosed
US-20090309068-A1 NOVEL ELECTROLUMINESCENT POLYMERS FOR ELECTRONIC APPLICATIONS UDC IRELAND LIMITED (IE) 2009-12-17 — — US disclosed
US-20090105447-A1 Novel Polymers UDC IRELAND LIMITED (IE) 2009-04-23 — — US disclosed
US-20090005505-A1 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2009-01-01 — — US disclosed
US-7323533-B2 Conjugated polymers containing spirobifluorene units and the use thereof COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2008-01-29 — — US disclosed
US-20070265473-A1 CONJUGATED POLYMERS CONTAINING SPIROBIFLUORENE UNITS AND THE USE THEREOF COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2007-11-15 — — US disclosed
US-7288617-B2 Conjugated polymers containing spirobifluorene units and fluorene units, and the use thereof MERCK PATENT GMBH (DE) 2007-10-30 — — US disclosed
US-20070228359-A1 Novel Diketopyrrolopyrrole Polymers CLAP CO., LTD. (KR) 2007-10-04 — — US disclosed
US-20070060736-A1 Conjugated polymers containing dihydrophenanthrene units and use thereof MERCK PATENT GMBH (DE) 2007-03-15 — — 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 (3 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-20090105447-A1 Novel Polymers PLEC, VIM, PUF60 ADRA2A 4264/4885ADRA2B 4177/4885ADRA2C 4163/4885
US-20090321686-A1 1,4-BIS(2-THIENYLVINYL)BENZOL DERIVATIVES AND THEIR USE TTL, VCL, BRD4 ADRA2A 1627/4885ADRA2B 775/4885ADRA2C 1663/4885
US-20070265473-A1 CONJUGATED POLYMERS CONTAINING SPIROBIFLUORENE UNITS AND THE USE THEREOF ALDH1A2, SELE, PPOX ADRA2A 2898/4885ADRA2B 2051/4885ADRA2C 2739/4885

“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.