SCHEMBL21148733

SCHEMBL21148733

c1ccc(-c2nc(-c3ccc(-c4cccc5sc6ccccc6c45)cc3)nc(-c3cccc(-c4cccc5c4sc4ccccc45)c3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.51
LIMK1 P53667 2/20 0.43
PRKDC P78527 5/20 0.37
PARP14 Q460N5 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
F9 P00740 1/20 0.34
MAPT P10636 3/20 0.34
SLC9A1 P19634 1/20 0.34
GPR3 P46089 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
DNPH1 O43598 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 2/20 0.32

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
SCHEMBL21148569 1.00 ALOX5 (0.51) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL21149137 0.98 ALOX5 (0.50) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL21148245 0.95 ALOX5 (0.48) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL21148604 0.95 ALOX5 (0.49) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL25458800 0.94 ALOX5 (0.48) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL21148598 0.94 ALOX5 (0.47) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL21148732 0.94 ALOX5 (0.47) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL25852628 0.93 ALOX5 (0.46) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL22248770 0.93 ALOX5 (0.48) ALOX5LIMK1PRKDCPARP14TNKS
SCHEMBL26728832 0.93 ALOX5 (0.47) ALOX5LIMK1PRKDCPARP14TNKS

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
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-07-11 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 (2 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-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 ALOX5 306/4885LIMK1 133/4885PRKDC 3522/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 ALOX5 306/4885LIMK1 133/4885PRKDC 3522/4885

“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.