SCHEMBL1102574

SCHEMBL1102574

CC(C)(C)c1ccc(-c2c3ccccc3c(-c3ccc(C(C)(C)C)cc3)c3cnccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.53
NPC1 O15118 4/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
HTT P42858 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDR P35968 2/20 0.41
MEN1 O00255 1/20 0.41
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
TRPV1 Q8NER1 3/20 0.39
RAB9A P51151 3/20 0.39
TP53 P04637 2/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 2/20 0.38
DGAT1 O75907 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
SCHEMBL1102559 0.97 KIF11 (0.54) KIF11NPC1LMNAMAPTHTT
SCHEMBL1102746 0.89 KIF11 (0.43) KIF11NPC1LMNAMAPTHTT
SCHEMBL1102805 0.88 KDR (0.49) KIF11NPC1LMNAMAPTHTT
SCHEMBL12887412 0.87 KIF11 (0.43) KIF11NPC1LMNAMAPTHTT
SCHEMBL12886995 0.87 KIF11 (0.41) KIF11NPC1LMNAMAPTHTT
SCHEMBL1103627 0.85 KIF11 (0.49) KIF11MAPTALDH1A1
SCHEMBL1103616 0.84 KIF11 (0.44) KIF11KDRTRPV1
SCHEMBL12887052 0.84 KIF11 (0.41) KIF11NPC1LMNAMAPTHTT
SCHEMBL12886736 0.84 KIF11 (0.41) KIF11NPC1LMNAMAPTHTT
SCHEMBL5955995 0.84 KIF11 (0.46) KIF11NPC1LMNAKDM4EKMT2A

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 KIF11 2859/4885NPC1 1582/4885LMNA 2738/4885

“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.