SCHEMBL21687775

SCHEMBL21687775

N#Cc1ccc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2C#N)cc1-n1c2ccccc2c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
HIF1A Q16665 1/20 0.34
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PDE9A O76083 1/20 0.32
PDE1C Q14123 1/20 0.32
ALDH1A1 P00352 5/20 0.31
MAPK1 P28482 4/20 0.31
KDM4E B2RXH2 3/20 0.31
HPGD P15428 3/20 0.31
GAA P10253 1/20 0.31
TRPA1 O75762 1/20 0.31
MEN1 O00255 2/20 0.31
TSHR P16473 2/20 0.31
KMT2A Q03164 2/20 0.31
AR P10275 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TGFBR1 P36897 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31

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
SCHEMBL21687561 0.93 PTGER4 (0.31) SMN1; SMN2HIF1AALDH1A1MAPK1MEN1
SCHEMBL21687557 0.92 SMN1; SMN2 (0.35) SMN1; SMN2HIF1ACYP11B1CYP11B2PDE9A
SCHEMBL21687984 0.91 CYP11B2 (0.34) SMN1; SMN2CYP11B1CYP11B2ALDH1A1MAPK1
SCHEMBL21688048 0.88 SMN1; SMN2 (0.40) SMN1; SMN2HIF1ACYP11B1CYP11B2PDE9A
SCHEMBL21687733 0.86 SMN1; SMN2 (0.40) SMN1; SMN2HIF1ACYP11B1CYP11B2PDE9A
SCHEMBL21687455 0.85 KDM4E (0.39) SMN1; SMN2HIF1ACYP11B2ALDH1A1MAPK1
SCHEMBL21688076 0.85 KDM4E (0.41) SMN1; SMN2CYP11B2PDE9APDE1CALDH1A1
SCHEMBL21687767 0.84 SMN1; SMN2 (0.34) SMN1; SMN2HIF1AALDH1A1MAPK1KDM4E
SCHEMBL21688109 0.84 TRPA1 (0.34) SMN1; SMN2HIF1ACYP11B1CYP11B2ALDH1A1
SCHEMBL21687628 0.84 CYP11B2 (0.34) SMN1; SMN2HIF1ACYP11B1CYP11B2ALDH1A1

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 SMN1; SMN2 4039/4885HIF1A 622/4885CYP11B1 1222/4885
US-11201300-B2 Condensed cyclic compound and organic light-emitting device including condensed cyclic compound CRY1, CCNL2, CCNE2 SMN1; SMN2 4039/4885HIF1A 622/4885CYP11B1 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.