SCHEMBL22456795

SCHEMBL22456795

CP(C)(=O)c1ccc2c3ccccc3c3nc4c5ccccc5ccc4n3c2c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TLR8 Q9NR97 1/20 0.34
CYP1A2 P05177 6/20 0.34
POLR1A O95602 4/20 0.34
KCNH2 Q12809 5/20 0.33
HPRT1 P00492 1/20 0.33
MAOA P21397 1/20 0.32
ATM Q13315 1/20 0.32
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B10 Q99714 1/20 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
SCHEMBL22456747 0.94 TUBB4A (0.33) MAPTL3MBTL1TLR8CYP1A2POLR1A
SCHEMBL22456735 0.86 TUBB4A (0.34)
SCHEMBL22456736 0.86 PTGES (0.32) MAPTL3MBTL1TLR8CYP1A2POLR1A
SCHEMBL22456739 0.84 ESR1 (0.33) MAPTL3MBTL1TLR8MAOAHSD17B10
SCHEMBL22456523 0.83 TUBB4A (0.34) MAPTL3MBTL1TLR8
SCHEMBL22456584 0.83 TSPO (0.32)
SCHEMBL22456532 0.80 KDM4E (0.49) MAPTCYP1A2ATMCYP2C9CYP2C19
SCHEMBL22456742 0.78 TUBB4A (0.36) MAPTALDH1A1HSD17B10
SCHEMBL22456393 0.76 KDM4E (0.43) MAPTL3MBTL1GAAALDH1A1HSD17B10
SCHEMBL22456803 0.75 KDM4E (0.46) MAPTCYP1A2CYP2C9CYP2C19GAA

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-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-09-24 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-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME NR2E3, NR2E1, NOX1 MAPT 4532/4885L3MBTL1 559/4885TLR8 3130/4885

“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.