SCHEMBL21691692

SCHEMBL21691692

N#Cc1cccc(-c2c(-c3ccc4sc5ccccc5c4c3)cccc2-c2ccc3sc4ccccc4c3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.43
ADORA2A P29274 2/20 0.40
ALOX5 P09917 1/20 0.40
PDK2 Q15119 1/20 0.38
MAP4K4 O95819 1/20 0.38
CLK4 Q9HAZ1 4/20 0.37
MAOB P27338 1/20 0.37
CHEK1 O14757 1/20 0.37
GPR3 P46089 1/20 0.37
PRF1 P14222 1/20 0.37
PDE10A Q9Y233 1/20 0.37
ENPP1 P22413 1/20 0.37
ADORA1 P30542 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 3/20 0.36
CYP3A4 P08684 3/20 0.36
MEN1 O00255 2/20 0.36
CYP2C19 P33261 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL21692507 1.00 ADRA2C (0.43) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21691724 0.97 ADRA2C (0.41) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21693223 0.96 ADRA2C (0.40) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21692620 0.95 ADORA2A (0.40) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21693222 0.94 ADRA2C (0.39) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21693050 0.94 ADRA2C (0.40) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21692490 0.93 ADRA2C (0.38) ADRA2CADORA2AALOX5PDK2MAP4K4
SCHEMBL21691828 0.92 ALOX5 (0.40) ADRA2CADORA2AALOX5GPR3ALDH1A1
SCHEMBL21692496 0.92 ADRA2C (0.43) ADRA2CADORA2AALOX5PDK2CLK4
SCHEMBL21691722 0.92 ADRA2C (0.42) ADRA2CADORA2APDK2MAP4K4CLK4

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-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-06 US disclosed
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-01-30 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-11053228-B2 Condensed cyclic compound, composition including the condensed cyclic compound, and organic light-emitting device including the condensed cyclic compound CCNL2, ARL1, CRY1 ADRA2C 776/4885ADORA2A 1953/4885ALOX5 2220/4885
US-20200031812-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CCNL2, ARL1, CRY1 ADRA2C 776/4885ADORA2A 1953/4885ALOX5 2220/4885

“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.