SCHEMBL20220182

SCHEMBL20220182

Clc1ccc(Oc2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.52
CYP1A2 P05177 1/20 0.52
GAA P10253 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NR1H2 P55055 2/20 0.50
NR1H3 Q13133 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
LTA4H P09960 3/20 0.49
HTT P42858 1/20 0.49
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
PTGS2 P35354 1/20 0.48
ADRB2 P07550 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL20220298 0.98 CYP1A2 (0.56) TDP1CYP1A2GAASMN1; SMN2NR1H2
SCHEMBL20220186 0.90 MAPK1 (0.55) TDP1CYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL21887691 0.88 MAPK1 (0.58) TDP1CYP1A2NR1H2NPC1RAB9A
SCHEMBL21882437 0.88 MAPK1 (0.53) TDP1CYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL22414079 0.88 MAPK1 (0.53) TDP1CYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL25985434 0.88 MAPK1 (0.53) TDP1CYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL25985400 0.88 MAPK1 (0.53) TDP1CYP1A2SMN1; SMN2NPC1RAB9A
SCHEMBL20894736 0.88 CYP1A2 (0.67) CYP1A2GAANR1H2NR1H3NPC1
SCHEMBL9889000 0.88 CYP1A2 (0.67) CYP1A2GAANR1H2NR1H3NPC1
SCHEMBL24476798 0.86 CYP1A2 (0.71) TDP1CYP1A2GAASMN1; SMN2NPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11730009-B2 Compound and organic light-emitting element comprising same LG CHEM, LTD. 2023-08-15 US disclosed
US-11730009-B2 Compound and organic light-emitting element comprising same LG CHEM, LTD. 2023-08-15 US disclosed
EP-3330265-B1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2020-04-15 EP disclosed
EP-3330265-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2018-06-06 EP 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-11730009-B2 Compound and organic light-emitting element comprising same CRY2, CRY1, NR2E3 TDP1 3773/4885CYP1A2 307/4885GAA 1377/4885

“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.