SCHEMBL19081775

SCHEMBL19081775

c1ccc2c(-c3c4ccccc4c(-c4ccc5oc6c(ccc7c6sc6ccc8ccccc8c67)c5c4)c4ccccc34)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.34
ESR2 Q92731 2/20 0.33
ESR1 P03372 1/20 0.33
AHR P35869 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
KMT2A Q03164 3/20 0.32
PAX8 Q06710 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 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
SCHEMBL19082052 0.97 ALOX5 (0.32) ALOX5ESR2ESR1AHRTDP1
SCHEMBL19082032 0.95 ALOX5 (0.36) ALOX5ESR2ESR1AHRTDP1
SCHEMBL19081807 0.90 CYP1A1 (0.38) ESR2ESR1AHRTDP1PAX8
SCHEMBL19082002 0.90 ABCG2 (0.36) ESR2ESR1AHRTDP1KMT2A
SCHEMBL19081817 0.89 ABCG2 (0.38) ESR2ESR1AHRTDP1KMT2A
SCHEMBL19081779 0.89 AHR (0.33) AHRTDP1KMT2APAX8RAB9A
SCHEMBL19081943 0.89 CYP1A1 (0.35) ALOX5AHRKMT2APAX8RAB9A
SCHEMBL19081838 0.88 CYP1A1 (0.35) ESR2ESR1AHRTDP1KMT2A
SCHEMBL19081933 0.88 ESR2 (0.33) ALOX5ESR2ESR1
SCHEMBL19082018 0.87 CYP1A1 (0.37) ESR2ESR1AHRTDP1KMT2A

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 ALOX5 1939/4885ESR2 542/4885ESR1 225/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ALOX5 1939/4885ESR2 542/4885ESR1 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.