SCHEMBL14101550

SCHEMBL14101550

c1ccc(-c2ccc3sc4ccc(-c5ccc(-c6ccc7ccc8cccc9ccc6c7c89)cc5-c5ccccc5)cc4c3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
F9 P00740 3/20 0.36
PIM3 Q86V86 1/20 0.36
ERBB2 P04626 1/20 0.36
CYP1A2 P05177 1/20 0.36
FYN P06241 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
AHR P35869 1/20 0.36
LIMK1 P53667 1/20 0.34
S1PR4 O95977 4/20 0.34
S1PR5 Q9H228 4/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ROCK1 Q13464 1/20 0.33
SLC9A1 P19634 1/20 0.33
PIK3CA P42336 2/20 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
SCHEMBL14101495 0.97 F9 (0.38) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101455 0.96 F9 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101445 0.96 F9 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101555 0.95 S1PR5 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101531 0.95 PIM3 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101462 0.95 F9 (0.40) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101541 0.95 F9 (0.40) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101542 0.95 PIM3 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101547 0.94 F9 (0.39) HSD17B1HSD17B2F9PIM3ERBB2
SCHEMBL14101476 0.93 F9 (0.39) HSD17B1HSD17B2F9PIM3ERBB2

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 HSD17B1 865/4885HSD17B2 1123/4885F9 3290/4885

“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.