SCHEMBL14101646

SCHEMBL14101646

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)sc3cc(-c5ccccc5)ccc34)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 15/20 0.44
LIMK1 P53667 1/20 0.37
MEN1 O00255 1/20 0.35
APAF1 O14727 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
XBP1 P17861 1/20 0.35
PTBP1 P26599 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
GALK1 P51570 1/20 0.35
BLM P54132 1/20 0.35
SMAD3 P84022 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL14101649 1.00 PDK2 (0.44) PDK2LIMK1MEN1APAF1NPC1
SCHEMBL14101650 0.97 PDK2 (0.43) PDK2LIMK1F9
SCHEMBL14101606 0.97 PDK2 (0.40) PDK2
SCHEMBL10018848 0.96 PDK2 (0.38) PDK2LIMK1MAPTRAB9ASMN1; SMN2
SCHEMBL14101647 0.94 PDK2 (0.40) PDK2LIMK1F9
SCHEMBL20017369 0.91 ALDH1A1 (0.41) PDK2LIMK1MAPTRAB9ASMN1; SMN2
SCHEMBL22240882 0.90 PDK2 (0.36) PDK2LIMK1MEN1LMNAMAPT
SCHEMBL19444987 0.89 PDK2 (0.37) PDK2LIMK1MAPTRAB9ASMN1; SMN2
SCHEMBL19152430 0.88 PDK2 (0.36) PDK2LIMK1F9
SCHEMBL24287557 0.88 PDK2 (0.42) PDK2LIMK1

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 PDK2 770/4885LIMK1 167/4885MEN1 3063/4885

“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.