SCHEMBL22894103

SCHEMBL22894103

c1ccc2cc3c(cc2c1)c1c2ccccc2ccc1n3-c1nc(-c2cc3ccccc3c3c2oc2ccccc23)c2ccccc2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 3/20 0.31
MAPT P10636 3/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
HPGD P15428 2/20 0.30
USP2 O75604 1/20 0.30
GABRP O00591 1/20 0.30
GABRD O14764 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30
GABRA4 P48169 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
SCHEMBL22894104 0.93 L3MBTL1 (0.36) TDP1L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL21213128 0.90 KDM4E (0.32) TDP1L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL21213576 0.89 ALOX5 (0.34) TDP1L3MBTL1ALDH1A1MAPTSIRT2
SCHEMBL22894035 0.89 TDP1 (0.31) TDP1L3MBTL1SIRT2SIRT1
SCHEMBL22894037 0.87
SCHEMBL22894015 0.87 TDP1 (0.33) TDP1L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL22894036 0.85
SCHEMBL22893787 0.85 SIRT2 (0.32) L3MBTL1KDM4ESIRT2SIRT1
SCHEMBL22893736 0.84 KDM4E (0.33) TDP1L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL22894105 0.83 L3MBTL1 (0.38) TDP1L3MBTL1KDM4EALDH1A1MAPT

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-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2021-01-14 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-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 TDP1 2654/4885L3MBTL1 1367/4885KDM4E 2673/4885

“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.