SCHEMBL19082090

SCHEMBL19082090

c1ccc(-c2c3ccccc3c(-c3ccc4sc5cc6sc7ccc8ccccc8c7c6cc5c4c3)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.36
NQO1 P15559 1/20 0.36
ESR1 P03372 4/20 0.34
ESR2 Q92731 4/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CYP1A1 P04798 2/20 0.33
ABCG2 Q9UNQ0 2/20 0.33
CYP1A2 P05177 1/20 0.33
FYN P06241 1/20 0.33
MAPK3 P27361 1/20 0.33
AHR P35869 1/20 0.33
PAX8 Q06710 1/20 0.33
CYP1B1 Q16678 1/20 0.33
CHEK1 O14757 1/20 0.33
WEE1 P30291 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX5 P09917 1/20 0.32

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
SCHEMBL19082143 0.99 CDK4 (0.36) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082337 0.96 ESR1 (0.35) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082247 0.96 CDK4 (0.34) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082209 0.96 CDK4 (0.39) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082085 0.96 NQO2 (0.37) NQO2NQO1ESR1ESR2CDK4
SCHEMBL17944798 0.94 NQO2 (0.39) NQO2NQO1ESR1ESR2CDK4
SCHEMBL17945217 0.93 NQO2 (0.38) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082231 0.92 NQO2 (0.35) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082336 0.92 ESR1 (0.35) NQO2NQO1ESR1ESR2CDK4
SCHEMBL19082145 0.92 F9 (0.35) NQO2NQO1ESR1ESR2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 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-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same CRY1, CRY2, CCNT1 NQO2 2592/4885NQO1 576/4885ESR1 225/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 NQO2 2592/4885NQO1 576/4885ESR1 225/4885

“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.