SCHEMBL21687995

SCHEMBL21687995

N#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccc(-c2ccccc2[Si](c2ccccc2)(c2ccccc2)c2ccccc2C#N)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.35
TDP2 O95551 5/20 0.34
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ESR2 Q92731 1/20 0.32
G6PD P11413 1/20 0.31
USP14 P54578 1/20 0.31
CYP19A1 P11511 1/20 0.30
KDM1A O60341 1/20 0.30
TNKS2 Q9H2K2 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
SCHEMBL21688035 0.97 NR3C1 (0.33) NR3C1TDP2ALDH1A1LMNAHPGD
SCHEMBL21688033 0.92 TDP2 (0.35) TDP2ALDH1A1G6PDUSP14CYP19A1
SCHEMBL21687992 0.90 TDP2 (0.34) TDP2G6PDUSP14CYP19A1
SCHEMBL21687990 0.90 ALDH1A1 (0.34) NR3C1TDP2ALDH1A1LMNAHPGD
SCHEMBL21687469 0.90 GABRA1 (0.36) NR3C1TDP2ALDH1A1LMNAHPGD
SCHEMBL21688216 0.89 KDM4E (0.37) TDP2G6PDUSP14CYP19A1KDM1A
SCHEMBL21687835 0.88 RARG (0.33) TDP2ALDH1A1LMNAMAPK1G6PD
SCHEMBL21687986 0.88 KDM4E (0.40) NR3C1ALDH1A1LMNAHPGDMAPK1
SCHEMBL21687748 0.87 PTGER4 (0.36) TDP2USP14
SCHEMBL21687467 0.87 SMN1; SMN2 (0.32) NR3C1TDP2SMN1; SMN2ESR2CYP19A1

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 NR3C1 667/4885TDP2 4123/4885ALDH1A1 616/4885
US-11201300-B2 Condensed cyclic compound and organic light-emitting device including condensed cyclic compound CRY1, CCNL2, CCNE2 NR3C1 667/4885TDP2 4123/4885ALDH1A1 616/4885

“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.