SCHEMBL22894102

SCHEMBL22894102

c1ccc2c(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3nc(-c4cc5oc6ccccc6c5c5ccccc45)c4ccccc4n3)cccc2c1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MCL1 Q07820 1/20 0.30
ACMSD Q8TDX5 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL22893802 0.89 NPC1 (0.36) ALDH1A1MAPTTDP1L3MBTL1NPC1
SCHEMBL22893997 0.88 SIRT2 (0.33) L3MBTL1NPC1RAB9AKDM4E
SCHEMBL22894101 0.88 L3MBTL1 (0.36) ALDH1A1MAPTTDP1L3MBTL1NPC1
SCHEMBL22893690 0.88 ALDH1A1 (0.32) ALDH1A1MAPTMCL1ACMSDKDM4E
SCHEMBL22893945 0.86 NPC1 (0.33) TDP1L3MBTL1NPC1RAB9A
SCHEMBL22893938 0.86 ALDH1A1 (0.34) ALDH1A1MAPTTDP1L3MBTL1MCL1
SCHEMBL15791099 0.85 ALDH1A1 (0.43) ALDH1A1MAPTTDP1L3MBTL1MCL1
SCHEMBL19918485 0.85 KDM4E (0.32) ALDH1A1MAPTTDP1L3MBTL1KDM4E
SCHEMBL18849953 0.85 ALDH1A1 (0.31) ALDH1A1MAPTHPGD
SCHEMBL22893962 0.84 TDP1 (0.30) TDP1L3MBTL1

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 ALDH1A1 9/4885MAPT 1428/4885TDP1 2654/4885

“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.