SCHEMBL16658476

SCHEMBL16658476

c1ccc(-c2cc(-c3cc(-c4ccncc4)cc(-c4ccncc4)c3)c(-c3ccccc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.42
TNF P01375 1/20 0.41
ALDH1A1 P00352 5/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
IMPDH2 P12268 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.38
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
IKBKE Q14164 1/20 0.37
PKMYT1 Q99640 1/20 0.37
MAPK11 Q15759 2/20 0.37
MAPK14 Q16539 2/20 0.37
PIK3CA P42336 1/20 0.37
CSNK1D P48730 1/20 0.36
PRKCI P41743 1/20 0.36
MAPK1 P28482 2/20 0.35

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
SCHEMBL16658474 0.94 IMPDH2 (0.42) NOTUMTNFALDH1A1MAPTKDM4E
SCHEMBL16658503 0.94 NOTUM (0.44) NOTUMTNFALDH1A1MAPTKDM4E
SCHEMBL2734566 0.94 TNF (0.45) NOTUMTNFALDH1A1MAPTKDM4E
SCHEMBL16658475 0.86 CYP11B1 (0.43) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL76389 0.85 ALDH1A1 (0.44) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL16859291 0.85 ALDH1A1 (0.44) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL2158220 0.85 ALDH1A1 (0.47) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL16658485 0.83 ALDH1A1 (0.37) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL16658470 0.82 CYP11B1 (0.48) TNFALDH1A1MAPTKDM4EHPGD
SCHEMBL16670006 0.82 ALDH1A1 (0.41) TNFALDH1A1MAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10026901-B2 Organic electronic material and organic electroluminescent device GUANGDONG AGLAIA OPTOELECTRONICS MATERIALS CO., LTD (CN) 2018-07-17 US disclosed
US-10026901-B2 Organic electronic material and organic electroluminescent device GUANGDONG AGLAIA OPTOELECTRONICS MATERIALS CO., LTD (CN) 2018-07-17 US disclosed
US-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE BEIJING AGLAIA TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-04-23 US disclosed
US-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE BEIJING AGLAIA TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-04-23 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 (2 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-20150108449-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE OCIAD1, OCIAD2, SLCO4C1 NOTUM 1854/4885TNF 3633/4885ALDH1A1 1789/4885
US-10026901-B2 Organic electronic material and organic electroluminescent device OCIAD1, OCIAD2, SLCO4C1 NOTUM 1854/4885TNF 3633/4885ALDH1A1 1789/4885

“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.