SCHEMBL22019102

SCHEMBL22019102

Clc1cccc2sc3c(-c4ccccc4)cccc3c12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.47
LIMK1 P53667 2/20 0.44
ALOX5 P09917 1/20 0.44
MCL1 Q07820 2/20 0.41
MAPK1 P28482 1/20 0.41
F9 P00740 1/20 0.38
MAPK14 Q16539 1/20 0.36
PARP14 Q460N5 1/20 0.35
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
OGG1 O15527 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 2/20 0.34
SLC9A1 P19634 1/20 0.34

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
SCHEMBL25567635 0.97 ALOX5 (0.46) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL25567691 0.91 ALOX5 (0.47) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL21398775 0.87 ALOX5 (0.41) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL24969647 0.87 LIMK1 (0.48) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL30020492 0.86 CYP2A6 (0.39) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL25893403 0.86 ALOX5 (0.41) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL22700612 0.85 PRKCI (0.41) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL23098327 0.84 LIMK1 (0.38) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL25569776 0.84 LIMK1 (0.46) CYP2A6LIMK1ALOX5MCL1MAPK1
SCHEMBL23893340 0.83 LIMK1 (0.44) LIMK1ALOX5MCL1F9PARP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 WO disclosed
US-20220020932-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2022-01-20 US disclosed
WO-2020101169-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF 덕산네오룩스 주식회사 2020-05-22 WO 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-20220020932-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF PIEZO1, OR51E2, OR10J3 CYP2A6 1577/4885LIMK1 78/4885ALOX5 849/4885

“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.