SCHEMBL21392433

SCHEMBL21392433

CCc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3ccc5ccccc5c34)c3ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.38
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
PSMD14 O00487 1/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
BMI1 P35226 1/20 0.33
PTGER4 P35408 1/20 0.33
PTGES O14684 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL21392576 0.93 PDE10A (0.39) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392546 0.91 POLB (0.40) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392678 0.89 ESR1 (0.37) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392677 0.89 MAPK1 (0.45) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392653 0.89 RECQL (0.41) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392437 0.89 MAPK1 (0.34) PDE10ACYP1A2ALDH1A1KDM4EMAPT
SCHEMBL20127747 0.88 PDE10A (0.39) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL17246963 0.86 ALDH1A1 (0.36) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL17246878 0.86 PDE10A (0.39) PDE10ACYP1A2ALDH1A1KDM4EMEN1
SCHEMBL21392436 0.86 ESR1 (0.47) CYP1A2ALDH1A1KDM4EMEN1MAPT

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-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US disclosed
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US disclosed
US-20190296238-A1 Organic Light-emitting Element LG CHEM, LTD. (KR) 2019-09-26 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-20190296238-A1 Organic Light-emitting Element CRY1, CRY2, NR2E3 PDE10A 4353/4885CYP1A2 513/4885ALDH1A1 567/4885
US-11877509-B2 Organic light-emitting element CRY1, CRY2, NR2E3 PDE10A 4353/4885CYP1A2 513/4885ALDH1A1 567/4885

“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.