SCHEMBL14101473

SCHEMBL14101473

c1ccc2cc(-c3ccc4ccc5c(-c6ccc(-c7ccc8sc9ccc(-c%10ccc(-c%11ccc%12ccc%13c(-c%14ccc%15ccccc%15c%14)ccc%14ccc%11c%12c%14%13)cc%10)cc9c8c7)cc6)ccc6ccc3c4c65)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
S1PR5 Q9H228 10/20 0.39
S1PR4 O95977 7/20 0.39
ALOX5 P09917 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
F9 P00740 2/20 0.35
PIM3 Q86V86 1/20 0.34

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
SCHEMBL14101527 0.97 S1PR5 (0.40) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101463 0.97 S1PR5 (0.40) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101456 0.97 S1PR5 (0.40) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101530 0.96 S1PR5 (0.39) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101535 0.96 ESR1 (0.39) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101434 0.96 GSTP1 (0.43) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101468 0.94 S1PR5 (0.36) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101529 0.94 S1PR5 (0.41) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101441 0.93 S1PR5 (0.42) GSTP1ESR1ESR2S1PR5S1PR4
SCHEMBL14101540 0.92 S1PR5 (0.40) GSTP1ESR1ESR2S1PR5S1PR4

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-20080166594-A1 BENZOTHIOPHENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE MAKING USE OF THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-07-10 US disclosed
US-20080166594-A1 BENZOTHIOPHENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE MAKING USE OF THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-07-10 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 (1 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-20080166594-A1 BENZOTHIOPHENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE MAKING USE OF THE SAME CYBA, BPNT1, TYR GSTP1 731/4885ESR1 266/4885ESR2 309/4885

“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.