SCHEMBL1115839

SCHEMBL1115839

Cc1cc(C)c(N(c2ccc(Br)cc2)c2ccc(N(c3ccc(Br)cc3)c3c(C)cc(C)cc3C)cc2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 3/20 0.47
ALDH1A1 P00352 4/20 0.44
CYP2A6 P11509 2/20 0.35
S100B P04271 1/20 0.34
MAPK1 P28482 1/20 0.33
IGF1R P08069 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CYP1A2 P05177 2/20 0.31
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
APP P05067 1/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
DNMT1 P26358 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
SCHEMBL1115815 1.00 RAPGEF4 (0.47) RAPGEF4ALDH1A1CYP2A6S100BMAPK1
SCHEMBL2312299 0.96 ALDH1A1 (0.52) RAPGEF4ALDH1A1CYP2A6S100BMAPK1
SCHEMBL31405486 0.96 RAPGEF4 (0.47) RAPGEF4ALDH1A1CYP2A6S100BMAPK1
SCHEMBL15304825 0.89 RAPGEF4 (0.40) RAPGEF4ALDH1A1TSHRPOLB
SCHEMBL1116041 0.89 RAPGEF4 (0.40) RAPGEF4ALDH1A1TSHRPOLB
SCHEMBL21277238 0.86 RAPGEF4 (0.38) RAPGEF4ALDH1A1
SCHEMBL19154223 0.86 RAPGEF4 (0.38) RAPGEF4ALDH1A1CYP2A6CYP1A2
SCHEMBL2314652 0.85 ALDH1A1 (0.40) RAPGEF4ALDH1A1MAPK1IGF1RHTT
SCHEMBL14226928 0.85 RXRB (0.38) RAPGEF4ALDH1A1MAPK1TSHRAPP
SCHEMBL12018763 0.84 ALDH1A1 (0.46) RAPGEF4ALDH1A1CYP2A6S100BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10818843-B2 Polymer compound and light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-10-27 US disclosed
US-9929347-B2 Polymer compound and light emitting element using same SUMITOMO CHEMICAL COMPANY, LIMTIED (JP) 2018-03-27 US disclosed
US-20150115204-A1 POLYMER COMPOUND AND LIGHT EMITTING ELEMENT USING SAME CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-04-30 US disclosed
US-8519092-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-27 US disclosed
US-20120293749-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-22 US disclosed
US-20120293749-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-22 US disclosed
US-20120293749-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-22 US disclosed
US-8263735-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-11 US disclosed
US-8263735-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-11 US disclosed
US-8263735-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-11 US disclosed
EP-1394188-B1 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL CO (JP) 2011-02-02 EP disclosed
US-7772360-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-10 US disclosed
US-7772360-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-10 US disclosed
US-7772360-B2 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-10 US disclosed
US-20100133997-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100133997-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100133997-A1 POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 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-20150115204-A1 POLYMER COMPOUND AND LIGHT EMITTING ELEMENT USING SAME NAP1L4, AHR, NR0B1 RAPGEF4 3049/4885ALDH1A1 1239/4885CYP2A6 1234/4885

“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.