SCHEMBL21687746

SCHEMBL21687746

N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2cc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)ccc2C#N)ccc1C#N

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.33
RORC P51449 3/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30
FLT3 P36888 1/20 0.30
NR3C1 P04150 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
SCHEMBL21687794 0.94 PTGER4 (0.33) PTGER4CYP11B1CYP11B2MGAMGAA
SCHEMBL21688163 0.93 STS (0.33) PTGER4RORCCYP11B1CYP11B2MGAM
SCHEMBL21687856 0.93 CYP11B2 (0.34) CYP11B1CYP11B2NR3C1
SCHEMBL21687900 0.92 PTGER4 (0.35) PTGER4RORCCYP11B1CYP11B2MGAM
SCHEMBL21687688 0.91 KDM4E (0.35) PTGER4MGAMGAASIMGAM2
SCHEMBL21688022 0.90 PTGER4 (0.34) PTGER4RORCCYP11B1CYP11B2
SCHEMBL21687681 0.89 ALDH1A1 (0.35) PTGER4
SCHEMBL21688119 0.89 PTGER4 (0.32) PTGER4RORCGAA
SCHEMBL21687792 0.89 PTGER4 (0.34) PTGER4RORCMGAMGAASI
SCHEMBL21687712 0.88 CYP11B1 (0.34) CYP11B1CYP11B2GAAFLT3

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 1486/4885CYP11B1 1222/4885
US-11201300-B2 Condensed cyclic compound and organic light-emitting device including condensed cyclic compound CRY1, CCNL2, CCNE2 PTGER4 553/4885RORC 1486/4885CYP11B1 1222/4885

“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.