SCHEMBL1103523

SCHEMBL1103523

Cc1cccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3c2cnc2ccccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MET P08581 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
MAPK14 Q16539 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
NR1I3 Q14994 1/20 0.39
KMT2A Q03164 1/20 0.39
MAP4K4 O95819 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 2/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
ABCB1 P08183 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
CYP1A2 P05177 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
SCHEMBL1103518 0.91 MET (0.38) ALDH1A1HPGDHTTNPSR1MET
SCHEMBL1103261 0.91 ALDH1A1 (0.48) ALDH1A1HPGDHTTNPSR1BCHE
SCHEMBL1103531 0.90 ALDH1A1 (0.42) ALDH1A1HPGDHTTNPSR1MET
SCHEMBL1103356 0.90 CYP17A1 (0.41) ALDH1A1METNPC1RAB9AKMT2A
SCHEMBL1103507 0.90 CYP17A1 (0.41) ALDH1A1METNPC1RAB9AKMT2A
SCHEMBL1103452 0.90 KDM4E (0.43) ALDH1A1METNPC1RAB9ASMN1; SMN2
SCHEMBL1103719 0.90 KDM4E (0.43) ALDH1A1METNPC1RAB9ASMN1; SMN2
SCHEMBL1103488 0.89 ESR1 (0.46) ALDH1A1HPGDHTTNPSR1MET
SCHEMBL1103482 0.89 ESR1 (0.46) ALDH1A1HPGDHTTNPSR1MET
SCHEMBL1103402 0.89 ALDH1A1 (0.52) ALDH1A1HPGDHTTNPSR1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
EP-2147962-A1 Azaanthracene-derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-27 EP 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 ALDH1A1 1015/4885HPGD 2787/4885HTT 4390/4885

“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.