SCHEMBL20089435

SCHEMBL20089435

c1cncc(-c2cccc(-c3c4ccc5ccccc5c4nc4c3ccc3ccccc34)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.54
CYP11B2 P19099 7/20 0.54
CYP19A1 P11511 5/20 0.54
CYP17A1 P05093 3/20 0.54
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 3/20 0.50
HPGD P15428 3/20 0.50
RAB9A P51151 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 2/20 0.50
NPC1 O15118 2/20 0.50
POLB P06746 1/20 0.50
HTT P42858 1/20 0.50
CYP1A2 P05177 3/20 0.46
CYP1A1 P04798 1/20 0.46
PRKDC P78527 1/20 0.46
CYP1B1 Q16678 1/20 0.46
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL20081042 0.99 CYP11B1 (0.53) CYP11B1CYP11B2CYP19A1CYP17A1KDM4E
SCHEMBL21731002 0.91 CYP11B2 (0.59) CYP11B1CYP11B2CYP19A1CYP17A1KDM4E
SCHEMBL16438150 0.90 KDM4E (0.56) CYP11B1CYP11B2CYP19A1CYP17A1KDM4E
SCHEMBL20081091 0.88 MAPT (0.45) ALDH1A1MAPTCYP1A2CYP1A1CYP1B1
SCHEMBL19036109 0.85 ALDH1A1 (0.45) CYP11B1CYP11B2CYP19A1CYP17A1KDM4E
SCHEMBL18660110 0.85 MAPT (0.42) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL30155095 0.85 MAPT (0.42) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL17621843 0.85 ESR1 (0.43) CYP19A1KDM4EALDH1A1MAPTHPGD
SCHEMBL20089434 0.84 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1CYP17A1KDM4E
SCHEMBL20081070 0.83 ESR1 (0.42) CYP19A1KDM4EALDH1A1MAPTHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11011708-B2 Electron transport layer stack for an organic light-emitting diode NOVALED GMBH (DE) 2021-05-18 US disclosed
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode NOVALED GMBH (DE) 2018-04-26 US disclosed
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode NOVALED GMBH (DE) 2018-04-26 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 (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-11011708-B2 Electron transport layer stack for an organic light-emitting diode SLCO4C1, SLC7A5, OCIAD1 CYP11B1 1028/4885CYP11B2 865/4885CYP19A1 2565/4885
US-20180114920-A1 Electron Transport Layer Stack for an Organic Light-Emitting Diode SLCO4C1, SLC7A5, OCIAD1 CYP11B1 1028/4885CYP11B2 865/4885CYP19A1 2565/4885

“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.