SCHEMBL17734598

SCHEMBL17734598

Cc1ccc(-c2ccc3nc(Cl)cc(Cl)c3c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
HSP90AB1 P08238 1/20 0.44
KDM4E B2RXH2 4/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 2/20 0.42
HIF1A Q16665 1/20 0.42
NT5E P21589 1/20 0.42
MAPKAPK2 P49137 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ESRRB O95718 1/20 0.41
ESR1 P03372 1/20 0.41
ESRRA P11474 1/20 0.41
ESR2 Q92731 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
PLG P00747 1/20 0.41
PLAU P00749 1/20 0.41
PLAT P00750 1/20 0.41
DHODH Q02127 1/20 0.41
MAPT P10636 3/20 0.41

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
SCHEMBL3499138 0.86 NT5E (0.51) LMNAHSP90AB1KDM4ENT5EMAPKAPK2
SCHEMBL829490 0.85 LMNA (0.72) LMNAKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL17734602 0.81 ESR1 (0.51) LMNAHSP90AB1KDM4EHIF1ANT5E
SCHEMBL10824124 0.78 LMNA (0.72) LMNAHSP90AB1NT5EALDH1A1ESRRB
SCHEMBL19618608 0.78 NT5E (0.44) KDM4ENT5EALDH1A1ESRRBESR1
SCHEMBL20851781 0.77 KDM4E (0.39) LMNAHSP90AB1KDM4ECYP3A4CYP2C19
SCHEMBL14690472 0.77 LMNA (0.56) LMNAHSP90AB1KDM4ECYP3A4CYP2C19
SCHEMBL20851773 0.76 ALDH1A1 (0.51) LMNAHSP90AB1KDM4ECYP3A4CYP2C19
SCHEMBL7059007 0.76 KDM4E (0.58) LMNAKDM4ECYP3A4CYP2C19HIF1A
SCHEMBL8899425 0.76 KDM4E (0.53) LMNAHSP90AB1KDM4EMAPKAPK2ALDH1A1

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-10033001-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2018-07-24 US disclosed
US-10033001-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2018-07-24 US disclosed
US-20170317297-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-11-02 US disclosed
US-20170317297-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-11-02 US disclosed
WO-2016072780-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-05-12 WO 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 (2 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-10033001-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same EPCAM, SOD1, ICOSLG LMNA 3158/4885HSP90AB1 790/4885KDM4E 1306/4885
US-20170317297-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME EPCAM, SOD1, ICOSLG LMNA 3158/4885HSP90AB1 790/4885KDM4E 1306/4885

“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.