SCHEMBL21431925

SCHEMBL21431925

c1ccc(-n2c3c4ccccc4ccc3c3c4c5ccccc5[nH]c4c4cc(-c5cccc6cc(-c7ccccn7)ccc56)ccc4c32)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.35
ALK Q9UM73 1/20 0.34
HTR2B P41595 1/20 0.34
HTR5A P47898 1/20 0.34
GRM5 P41594 2/20 0.32
HTR2C P28335 1/20 0.32
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 2/20 0.31
ALDH1A1 P00352 2/20 0.31
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CDK4 P11802 3/20 0.31

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
SCHEMBL19786355 0.85 KDM4E (0.35) GRM5HTR2CKDM4ENPC1ALDH1A1
SCHEMBL21432052 0.79 KIF11 (0.39) BCHEHTR2BHTR5AKDM4ENPC1
SCHEMBL19786531 0.79 GABRP (0.36) BCHEALKHTR2BHTR5AKDM4E
SCHEMBL19786526 0.78 KIF11 (0.49) KDM4EALDH1A1MAPTHPGDNPSR1
SCHEMBL19786739 0.77 KIF11 (0.46) HTR2BHTR5AKDM4EALDH1A1MAPT
SCHEMBL17299586 0.76 HTR2B (0.39) BCHEHTR2BHTR5APIM1PIM3
SCHEMBL21432023 0.75 HTR2B (0.39) ALKHTR2BHTR5AKDM4EALDH1A1
SCHEMBL19786650 0.75 KIF11 (0.38) HTR2BHTR5AKDM4EALDH1A1MAPT
SCHEMBL19786547 0.73 CDK4 (0.32) ALKCDK4CCND1CDK5CDK5R1
SCHEMBL21432042 0.72 GABRP (0.40) BCHEHTR2BHTR5AKDM4ENPC1

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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-10-03 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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, OR51E2, ORAI2 BCHE 2628/4885ALK 2194/4885HTR2B 4787/4885

“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.