SCHEMBL19984488

SCHEMBL19984488

CC(C)c1ccc2c(c1)C(=O)NCC(CC(C)c1ccc3c(c1)OCCNC3=O)O2

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP6 P51161 1/20 0.40
GSK3B P49841 1/20 0.34
MAPKAPK2 P49137 1/20 0.31
HPGD P15428 1/20 0.30
GFER P55789 1/20 0.30
HSD17B10 Q99714 1/20 0.30
JAK2 O60674 1/20 0.30
NTRK1 P04629 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL18090602 0.81 FABP6 (0.50) FABP6GSK3BMAPKAPK2HPGDGFER
SCHEMBL13392164 0.79 FABP6 (0.61) FABP6GSK3BMAPKAPK2HPGDGFER
SCHEMBL19977258 0.78 ALDH1A1 (0.40) HPGDHSD17B10MAPT
SCHEMBL13392166 0.69 HPGD (0.43) FABP6HPGDGFERHSD17B10TP53
SCHEMBL24701389 0.68 TDP1 (0.44)
SCHEMBL26009341 0.66 PTGS1 (0.48) HPGDTP53MAPTSMN1; SMN2
SCHEMBL19977257 0.65 HTR2A (0.35) TP53MAPT
SCHEMBL10274616 0.65 ALDH1A1 (0.56) FABP6GSK3BHSD17B10MAPT
SCHEMBL13092730 0.64 FABP6 (0.57) FABP6GSK3BMAPKAPK2HPGDHSD17B10
SCHEMBL24784239 0.64 FABP6 (0.47) FABP6GSK3BHSD17B10JAK2NTRK1

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-10233156-B2 9-membered fused ring derivative SHIONOGI & CO., LTD. (JP) 2019-03-19 US disclosed
US-20180079727-A1 9-MEMBERED FUSED RING DERIVATIVE SHIONOGI & CO., LTD. (JP) 2018-03-22 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-20180079727-A1 9-MEMBERED FUSED RING DERIVATIVE ACSS2, AGTR2, ACSL3 FABP6 2548/4885GSK3B 2144/4885MAPKAPK2 1286/4885
US-10233156-B2 9-membered fused ring derivative AGTR2, ACSS2, ACSL3 FABP6 2770/4885GSK3B 2083/4885MAPKAPK2 1155/4885

“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.