SCHEMBL17429653

SCHEMBL17429653

COC(=O)c1ccc2c(c1)-c1c(C)cc(C)cc1CCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
BRD4 O60885 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
MAPT P10636 4/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
ATM Q13315 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
XDH P47989 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL17429665 0.95 TDP1 (0.44) TDP1BRD4SMN1; SMN2MAPTALDH1A1
SCHEMBL17386058 0.88 CA12 (0.41) TDP1BRD4SMN1; SMN2MAPTALDH1A1
SCHEMBL17386181 0.87 BRD4 (0.44) TDP1BRD4SMN1; SMN2MAPTNPC1
SCHEMBL17385841 0.83 CA12 (0.43) TDP1SMN1; SMN2MAPTALDH1A1ATM
SCHEMBL17386350 0.82 MAPT (0.44) TDP1BRD4SMN1; SMN2MAPTNPC1
SCHEMBL17429647 0.81 TDP1 (0.47) TDP1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL17429674 0.80 PTGER3 (0.47) TDP1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL17386086 0.80 FFAR1 (0.43) TDP1BRD4MAPTNPC1RAB9A
SCHEMBL12365311 0.80 TDP1 (0.40) TDP1BRD4SMN1; SMN2MAPTNPC1
SCHEMBL17418097 0.79 FFAR1 (0.41) BRD4MAPTATMCYP2C9

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-9643946-B2 Tricyclic compound and use thereof SK CHEMICALS CO., LTD. (KR) 2017-05-09 US disclosed
US-20160009677-A1 TRICYCLIC COMPOUND AND USE THEREOF SK CHEMICALS CO., LTD. (KR) 2016-01-14 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-20160009677-A1 TRICYCLIC COMPOUND AND USE THEREOF GPR65, GPR119, GPR35 TDP1 4431/4885BRD4 1490/4885SMN1; SMN2 3972/4885

“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.