SCHEMBL21149202

SCHEMBL21149202

c1ccc(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-c3cccc4sc5ccccc5c34)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.37
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
HPGD P15428 4/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
TSHR P16473 2/20 0.35
ALOX15 P16050 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2B P29275 1/20 0.35
ALOX5 P09917 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ATM Q13315 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TP53 P04637 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
SCHEMBL21149206 0.99 F9 (0.36) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL25557519 0.97 F9 (0.36) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL23790723 0.95 LIMK1 (0.35) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL24169848 0.95 PIM3 (0.37) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL26573575 0.95 PIM3 (0.37) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL21149199 0.95 F9 (0.36) F9ALOX5BRDTGPR3LIMK1
SCHEMBL19802881 0.95 F9 (0.36) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL24169537 0.95 LIMK1 (0.38) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL24169849 0.95 LIMK1 (0.38) F9ADORA2AADORA1ALDH1A1MAPT
SCHEMBL21149209 0.95 F9 (0.40) F9ADORA2AADORA1ALDH1A1MAPT

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 5 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
EP-3710557-B1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-05-18 EP disclosed
US-20200395548-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PERFORMANCE MATERIALS GERMANY GMBH (DE) 2020-12-17 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 (3 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 F9 479/4885ADORA2A 2653/4885ADORA1 2094/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 F9 479/4885ADORA2A 2653/4885ADORA1 2094/4885
US-20200395548-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES TRMT1, EED, TEC F9 4305/4885ADORA2A 2577/4885ADORA1 3814/4885

“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.