SCHEMBL25790034

SCHEMBL25790034

Cc1cccc(-c2ccc(-c3nc4ccccn4c3-c3ccccc3)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 6/20 0.54
AKT2 P31751 5/20 0.54
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 1/20 0.48
ADRA1B P35368 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ENPP3 O14638 2/20 0.43
NR1H4 Q96RI1 1/20 0.43
NTRK1 P04629 1/20 0.43
TSHR P16473 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL25790017 0.89 ALDH1A1 (0.59) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL23509784 0.88 AKT1 (0.46) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL13325764 0.87 ALDH1A1 (0.61) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL19953862 0.87 AKT1 (0.66) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL13599904 0.87 AKT1 (0.66) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL22673324 0.86 AKT1 (0.46) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL24479222 0.86 AKT1 (0.51) AKT1AKT2NPC1RAB9AALDH1A1
SCHEMBL24478989 0.85 AKT2 (0.55) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL24479474 0.85 AKT2 (0.55) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL24479002 0.85 AKT2 (0.55) AKT1AKT2NPC1RAB9AKDM4E

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 1 patent. 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

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 AKT1 2890/4885AKT2 3327/4885NPC1 3704/4885

“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.