SCHEMBL21924486

SCHEMBL21924486

c1ccc(-c2ccc3c(c2)c2cc4ccccc4cc2n3-c2nc3ccccc3nc2-c2cccc3c2c2ccccc2n3-c2ccccc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.32
PTGER4 P35408 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
FLT3 P36888 2/20 0.31
NPY5R Q15761 1/20 0.31
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
BMX P51813 1/20 0.31
ESR1 P03372 2/20 0.30
ESR2 Q92731 2/20 0.30
TLR4 O00206 1/20 0.30
IL1R1 P14778 1/20 0.30
GSR P00390 1/20 0.30
ACVR1 Q04771 1/20 0.30

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
SCHEMBL22425635 0.92 NPY5R (0.33) KDM4EATML3MBTL1PTGER4RXFP1
SCHEMBL21213124 0.92 KDM4E (0.40) KDM4EATML3MBTL1CYP1A2RXFP1
SCHEMBL22425562 0.92 PDE10A (0.35) PDE10AALK
SCHEMBL21923571 0.90 KDM4E (0.34) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL22425566 0.89 PDE10A (0.34) PDE10AKDM4EATML3MBTL1CYP1A2
SCHEMBL22425637 0.89 PDE10A (0.35) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL22425220 0.88 KDM4E (0.32) PDE10AKDM4EATML3MBTL1MEN1
SCHEMBL22425576 0.88 L3MBTL1 (0.38) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL22425527 0.87 KDM4E (0.35) KDM4EATML3MBTL1RXFP1FLT3
SCHEMBL21923537 0.87 ALDH1A1 (0.35) PDE10AKDM4EATML3MBTL1FLT3

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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-04-30 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-20200136058-A1 BENZOCARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1B1, CYP2C9, CYP1A1 PDE10A 4429/4885KDM4E 1216/4885ATM 3830/4885

“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.