SCHEMBL21687527

SCHEMBL21687527

N#Cc1ccc(-c2ccc(C#N)cc2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c(-n2c3ccccc3c3cc(C#N)ccc32)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.34
RORC P51449 7/20 0.32
ENPP3 O14638 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
G6PD P11413 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
ELANE P08246 1/20 0.30
TDP2 O95551 1/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 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
SCHEMBL21687554 0.96 PTGER4 (0.33) PTGER4ENPP3ALDH1A1KDM4EGLA
SCHEMBL21688026 0.94 PTGER4 (0.33) PTGER4RORCENPP3ALDH1A1KDM4E
SCHEMBL21687894 0.94 PTGER4 (0.33) PTGER4RORCENPP3ALDH1A1KDM4E
SCHEMBL21687536 0.93 PTGER4 (0.34) PTGER4RORCENPP3ALDH1A1KDM4E
SCHEMBL21688044 0.92 PTGER4 (0.33) PTGER4RORCENPP3ALDH1A1KDM4E
SCHEMBL21687625 0.91 ALDH1A1 (0.34) PTGER4ENPP3ALDH1A1KDM4EGLA
SCHEMBL21687843 0.91 GABRA1 (0.34) PTGER4RORCENPP3ALDH1A1KDM4E
SCHEMBL21687491 0.91 KDM4E (0.33) ALDH1A1KDM4EGLAGAAG6PD
SCHEMBL21687828 0.91 PTGER4 (0.33) PTGER4ENPP3ALDH1A1KDM4EGLA
SCHEMBL21688008 0.91 KDM4E (0.33) ALDH1A1KDM4EGLAGAAG6PD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11201300-B2 Condensed cyclic compound and organic light-emitting device including condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-12-14 US disclosed
US-20200044168-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-02-06 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-20200044168-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND CRY1, CCNL2, CCNE2 PTGER4 553/4885RORC 1486/4885ENPP3 3675/4885
US-11201300-B2 Condensed cyclic compound and organic light-emitting device including condensed cyclic compound CRY1, CCNL2, CCNE2 PTGER4 553/4885RORC 1486/4885ENPP3 3675/4885

“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.