SCHEMBL19081772

SCHEMBL19081772

c1ccc(-c2c3ccccc3c(-c3c4oc5cc6ccccc6cc5c4cc4sc5ccccc5c34)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.36
ESR1 P03372 4/20 0.36
PTPN1 P18031 4/20 0.35
ELANE P08246 1/20 0.34
PIK3CD O00329 1/20 0.31
XRCC6 P12956 1/20 0.31
XRCC5 P13010 1/20 0.31
PIK3CA P42336 1/20 0.31
PRKDC P78527 1/20 0.31
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
FYN P06241 1/20 0.30
MAPK3 P27361 1/20 0.30
AHR P35869 1/20 0.30
PAX8 Q06710 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30
GPR3 P46089 1/20 0.30
CHEK1 O14757 1/20 0.30
WEE1 P30291 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
SCHEMBL19081976 0.88 CYP1A1 (0.33) ESR2ESR1PTPN1ELANECYP1A1
SCHEMBL19081828 0.84 ABCG2 (0.39) PTPN1PRKDCCYP1A1CYP1A2FYN
SCHEMBL19081777 0.83 ESR2 (0.36) ESR2ESR1PTPN1ELANECYP1A1
SCHEMBL17945674 0.83 AHR (0.36) ESR2ESR1PTPN1AHRABCG2
SCHEMBL19082064 0.82 S1PR5 (0.33) PTPN1CYP1A1
SCHEMBL19081784 0.81 ESR2 (0.38) ESR2ESR1PTPN1ELANE
SCHEMBL17932261 0.81 NPC1 (0.33) CYP1A1CYP1A2AHR
SCHEMBL20363614 0.81 ESR1 (0.44) ESR2ESR1PIK3CDXRCC6XRCC5
SCHEMBL19082025 0.81 ABCG2 (0.38) ESR2ESR1PTPN1PRKDCCYP1A1
SCHEMBL19082013 0.81 ESR2 (0.34) ESR2ESR1PTPN1ELANECHEK1

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 ESR2 542/4885ESR1 225/4885PTPN1 4695/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ESR2 542/4885ESR1 225/4885PTPN1 4695/4885

“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.