SCHEMBL21161561

SCHEMBL21161561

c1ccc2c(-c3cccc4c3oc3ccccc34)nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)nc2c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
PRKDC P78527 5/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
ATM Q13315 2/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ADK P55263 1/20 0.31
CDK2 P24941 1/20 0.30
POLB P06746 1/20 0.30
GGPS1 O95749 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
SCHEMBL22893845 0.93 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL16785816 0.92 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBATM
SCHEMBL24030399 0.92 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21716524 0.91 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CBHDAC8
SCHEMBL15583010 0.91 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBATM
SCHEMBL21716572 0.90 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CBHDAC8
SCHEMBL21213731 0.88 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBATM
SCHEMBL24030347 0.88 ALOX5 (0.31) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL19653954 0.88 KDM4E (0.35) ALOX5PRKDCPIK3CDPIK3CBATM
SCHEMBL16706423 0.87 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBATM

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-20220216433-A1 ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-07-07 US disclosed
US-10971687-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-04-06 US disclosed
US-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2021-01-14 US disclosed
US-20190189930-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-06-20 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 (4 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-20220216433-A1 ELECTROLUMINESCENT DEVICE EML4, EMC2, L1CAM ALOX5 4395/4885PRKDC 3716/4885PIK3CD 3921/4885
US-10971687-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, XDH ALOX5 737/4885PRKDC 4085/4885PIK3CD 3677/4885
US-20190189930-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, XDH ALOX5 737/4885PRKDC 4085/4885PIK3CD 3677/4885
US-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 ALOX5 660/4885PRKDC 4556/4885PIK3CD 4563/4885

“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.