SCHEMBL1102874

SCHEMBL1102874

CC1(C)c2ccccc2N(c2c3ccccc3c(-c3ccccc3)c3ccncc23)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ALOX5 P09917 1/20 0.32
ATM Q13315 1/20 0.32
TNF P01375 1/20 0.32
AKT1 P31749 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAP2 P11137 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
THPO P40225 1/20 0.32
ABCC9 O60706 1/20 0.31
MAPK1 P28482 1/20 0.30
CDK4 P11802 1/20 0.30
CCND1 P24385 1/20 0.30
GAA P10253 1/20 0.30
HTR6 P50406 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
SCHEMBL1102553 0.91 LMNA (0.37) LMNAALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL1102847 0.86 CYP17A1 (0.36) ALDH1A1
SCHEMBL1102910 0.83 TNF (0.37) TNFALDH1A1MAPK1GAA
SCHEMBL12723365 0.83 KMT2A (0.33) LMNACYP1A2CYP2D6MAPK1GAA
SCHEMBL1102891 0.82 ALOX5 (0.36) ALOX5ATMTNFAKT1ALDH1A1
SCHEMBL1102773 0.81 ALOX5 (0.33) ALOX5ATMTNFAKT1MAP2
SCHEMBL1102658 0.81 ACHE (0.40) ALOX5TNFMAP2CYP1A2CYP3A4
SCHEMBL1102651 0.81 CYP11B1 (0.36) ALOX5ATMTNFAKT1MAP2
SCHEMBL1103064 0.80 ALDH1A1 (0.33) LMNAAKT1ALDH1A1MAPK1GAA
SCHEMBL13158610 0.80 HSD17B3 (0.32) CYP1A2CYP2D6MAPK1GAA

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-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

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 LMNA 2738/4885ALOX5 9/4885ATM 4432/4885

“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.