SCHEMBL25790019

SCHEMBL25790019

Clc1ccc(-c2ccc(-c3nc4ccccn4c3-c3ccccc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
NR1I3 Q14994 11/20 0.59
NR1I2 O75469 3/20 0.59
AKT1 P31749 3/20 0.59
AKT2 P31751 3/20 0.59
KDM4E B2RXH2 5/20 0.56
POLB P06746 1/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
GAA P10253 2/20 0.51
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SLC2A1 P11166 1/20 0.50

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
SCHEMBL19953862 0.92 AKT1 (0.66) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL13599904 0.92 AKT1 (0.66) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL5347018 0.89 NPC1 (0.66) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL25790036 0.89 NPC1 (0.56) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL22615103 0.88 NPC1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL24479413 0.88 AKT1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL22673557 0.88 AKT1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL24479218 0.88 AKT1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL22673697 0.88 AKT1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1
SCHEMBL24478955 0.88 AKT1 (0.61) NPC1RAB9ANR1I3NR1I2AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217820-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2023-07-06 US disclosed
US-20230217820-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2023-07-06 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-20230217820-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TELO2, SOD1, TERT NPC1 3704/4885RAB9A 2202/4885NR1I3 4749/4885

“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.