SCHEMBL1102572

SCHEMBL1102572

Cc1ccccc1-c1c2ccccc2c(-c2ccccc2)c2ccncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 0.47
CYP17A1 P05093 7/20 0.47
MAPK14 Q16539 1/20 0.47
TNF P01375 1/20 0.45
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
NPC1 O15118 3/20 0.40
HPGD P15428 3/20 0.40
TSHR P16473 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 3/20 0.40
NPY5R Q15761 1/20 0.40
AHR P35869 1/20 0.40
DHODH Q02127 1/20 0.40
ALDH1A1 P00352 3/20 0.38
LMNA P02545 3/20 0.38
CYP3A4 P08684 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 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
SCHEMBL1102630 0.92 MAPK14 (0.46) CYP1A2CYP17A1MAPK14TNFCSNK2A2
SCHEMBL16298711 0.86 SLC22A12 (0.43) CYP1A2CYP17A1MAPK14TNFNPC1
SCHEMBL1102621 0.85 MAPT (0.43) CYP1A2CYP17A1MAPK14TNFNPC1
SCHEMBL1102612 0.85 TNF (0.53) CYP1A2CYP17A1TNFHPGDTSHR
SCHEMBL1102661 0.85 TNF (0.47) CYP1A2CYP17A1TNFHPGDSMN1; SMN2
SCHEMBL21224352 0.85 ACHE (0.45) CYP1A2MAPK14NPC1HPGDTSHR
SCHEMBL1102490 0.85 TNF (0.48) CYP1A2TNFHPGDSMN1; SMN2KDM4E
SCHEMBL1102754 0.83 CYP11B1 (0.43) CYP1A2CYP17A1MAPK14TNFCSNK2A2
SCHEMBL1102975 0.83 TNF (0.47) CYP1A2CYP17A1MAPK14TNFCSNK2A2
SCHEMBL1103649 0.83 TNF (0.41) CYP1A2CYP17A1MAPK14TNFNPC1

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 CYP1A2 1437/4885CYP17A1 2034/4885MAPK14 3348/4885

“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.