SCHEMBL19081959

SCHEMBL19081959

c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccc6sc7cc8c(cc7c6c5)oc5cc6ccccc6cc58)cc4)c4ccccc34)ccc2c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.34
ESR2 Q92731 3/20 0.34
S1PR5 Q9H228 8/20 0.33
S1PR4 O95977 7/20 0.33
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP1A2 P05177 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX5 P09917 1/20 0.31
GPR84 Q9NQS5 1/20 0.30
PGR P06401 1/20 0.30
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 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
SCHEMBL19081869 0.95 PGR (0.35) ESR1ESR2S1PR5S1PR4CYP1A1
SCHEMBL19076925 0.94 GPR3 (0.33) CYP1A2SMN1; SMN2
SCHEMBL19076871 0.93 ESR1 (0.34) ESR1ESR2S1PR5S1PR4CYP1A1
SCHEMBL19081886 0.93 ESR1 (0.38) ESR1ESR2ALOX5PGR
SCHEMBL24342845 0.92 AHR (0.33) ESR1ESR2S1PR5S1PR4CYP1A1
SCHEMBL17944376 0.92 CASP3 (0.33) ESR1ESR2S1PR5S1PR4CYP1A1
SCHEMBL19080178 0.92 GPR3 (0.34) ESR1ESR2S1PR5S1PR4CYP1A2
SCHEMBL18268514 0.90 AHR (0.37) S1PR5S1PR4CYP1A1CYP1B1CYP1A2
SCHEMBL19076729 0.89 AHR (0.35) ESR1ESR2S1PR5S1PR4CYP1A1
SCHEMBL17944803 0.89 SMN1; SMN2 (0.35) ESR1ESR2S1PR5S1PR4CYP1A1

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 ESR1 225/4885ESR2 542/4885S1PR5 4728/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ESR1 225/4885ESR2 542/4885S1PR5 4728/4885

“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.