SCHEMBL2541698

SCHEMBL2541698

Cc1ccc(N(c2ccc(C)c(C)c2)c2cc3c4ccccc4c(N(c4ccc(C)cc4)c4ccc(C)c(C)c4)cc3c3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
S1PR1 P21453 1/20 0.35
CYP1A2 P05177 2/20 0.33
TP53 P04637 2/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 1/20 0.31
POLB P06746 1/20 0.31
CYP2A6 P11509 1/20 0.31
MPI P34949 1/20 0.31
PHOSPHO1 Q8TCT1 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 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
SCHEMBL23334227 1.00 MAPT (0.37) MAPTNPSR1S1PR1CYP1A2TP53
SCHEMBL1376567 0.93 CYP1A2 (0.38) MAPTNPSR1S1PR1CYP1A2TP53
SCHEMBL13775273 0.92 KIF11 (0.34) MAPTNPSR1S1PR1CYP1A2TP53
SCHEMBL18978244 0.92 S1PR1 (0.36) MAPTNPSR1S1PR1CYP1A2ALDH1A1
SCHEMBL13775185 0.91 KIF11 (0.33) MAPTNPSR1S1PR1CYP1A2TP53
SCHEMBL12903352 0.90 MAPT (0.35) MAPTNPSR1S1PR1TP53
SCHEMBL74544 0.90 TSHR (0.38) NPSR1S1PR1CYP1A2ALDH1A1LMNA
SCHEMBL29556501 0.90 TSHR (0.38) NPSR1S1PR1CYP1A2ALDH1A1LMNA
SCHEMBL20115617 0.89 CYP1A2 (0.39) MAPTNPSR1S1PR1CYP1A2TP53
SCHEMBL22246993 0.87 S1PR1 (0.35) S1PR1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9368728-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2016-06-14 US disclosed
US-9368728-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2016-06-14 US disclosed
US-8178218-B2 Material for organic electroluminescent device and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2012-05-15 US disclosed
US-8178218-B2 Material for organic electroluminescent device and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2012-05-15 US disclosed
US-20110260604-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-10-27 US disclosed
US-20110260604-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-10-27 US disclosed
US-8044390-B2 Material for organic electroluminescent device, organic electroluminescent device, and organic electroluminescent display IDEMITSU KOSAN CO., LTD. (JP) 2011-10-25 US disclosed
US-20100181555-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC ELECTROLUMINESCENT DEVICE, AND ORGANIC ELECTROLUMINESCENT DISPLAY IDEMITSU KOSAN CO., LTD. (JP) 2010-07-22 US disclosed
US-20090195149-A1 Material for organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2009-08-06 US disclosed
US-20090195149-A1 Material for organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2009-08-06 US disclosed
US-20070155991-A1 Material for organic electroluminescent device and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-07-05 US disclosed
US-20070155991-A1 Material for organic electroluminescent device and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-07-05 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-20110260604-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE EML4, VCL, DNMT3L MAPT 1570/4885NPSR1 3960/4885S1PR1 3291/4885
US-20090195149-A1 Material for organic electroluminescent device using same EML4, INCENP, EZH2 MAPT 708/4885NPSR1 4701/4885S1PR1 4585/4885
US-20100181555-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC ELECTROLUMINESCENT DEVICE, AND ORGANIC ELECTROLUMINESCENT DISPLAY AFF4, CLIC4, L1CAM MAPT 3990/4885NPSR1 2352/4885S1PR1 3744/4885
US-20070155991-A1 Material for organic electroluminescent device and organic electroluminescent device using same CD99, EML4, L1CAM MAPT 814/4885NPSR1 4709/4885S1PR1 4456/4885

“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.