SCHEMBL1102471

SCHEMBL1102471

CC(C)c1cc(-c2ccncc2)nc(-c2ccncc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.49
LATS1 O95835 6/20 0.40
LATS2 Q9NRM7 5/20 0.40
NPC1 O15118 2/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38
HPGD P15428 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL17563611 0.93 KMT2A (0.46) GSK3BCYP3A4CYP2C9KDM4EMEN1
SCHEMBL21347891 0.84 ABCG2 (0.44) GSK3BLATS1LATS2NPC1MEN1
SCHEMBL1102447 0.83 ADORA2A (0.53) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL26496047 0.80 MEN1 (0.53) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL12786337 0.80 MAPT (0.50) GSK3BNPC1CYP3A4CYP2C9KDM4E
SCHEMBL24589786 0.76 MAPT (0.52) GSK3BNPC1KDM4EMEN1ALDH1A1
SCHEMBL17694986 0.76 MAPT (0.52) GSK3BNPC1KDM4EMEN1ALDH1A1
SCHEMBL17694987 0.76 MAPT (0.52) GSK3BNPC1KDM4EMEN1ALDH1A1
SCHEMBL13086515 0.76 NPC1 (0.47) GSK3BLATS1LATS2NPC1ALDH1A1
SCHEMBL11996110 0.75 GSK3B (0.53) GSK3BLATS1LATS2KDM4EMEN1

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-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100096982-A1 Novel organic electroluminescent compounds and organic electrouminescent device using the same GRACEL DISPLAY INC. (KR) 2010-04-22 US disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 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

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-20100096982-A1 Novel organic electroluminescent compounds and organic electrouminescent device using the same OCIAD1, OR10J3, ORMDL3 GSK3B 3771/4885LATS1 1293/4885LATS2 1014/4885
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same RPL36, RPL39, RPL36A GSK3B 4033/4885LATS1 807/4885LATS2 759/4885
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 GSK3B 3423/4885LATS1 1784/4885LATS2 834/4885

“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.