SCHEMBL31078014

SCHEMBL31078014

CC(C)(C)OC(=O)N1CCC(O)(C(F)(F)F)CC1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.38
HSD11B1 P28845 3/20 0.35
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
NPC1 O15118 1/20 0.33
EPHX2 P34913 1/20 0.33
NR1H2 P55055 3/20 0.33
RXRA P19793 2/20 0.33
NR1H3 Q13133 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM1A O60341 1/20 0.32
USP2 O75604 1/20 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
SCHEMBL20446514 0.86 HSD17B10 (0.39) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL15718593 0.86 HSD17B10 (0.39) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL19066055 0.86 HSD17B10 (0.39) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL2126924 0.82 HSD17B10 (0.45) HSD17B10SMN1; SMN2HSD11B1NPC1EPHX2
SCHEMBL31148270 0.82 HSD17B10 (0.45) HSD17B10SMN1; SMN2HSD11B1NPC1EPHX2
SCHEMBL10215476 0.82 HSD17B10 (0.45) HSD17B10SMN1; SMN2HSD11B1NPC1EPHX2
SCHEMBL31078106 0.81 HSD17B10 (0.39) HSD17B10SMN1; SMN2HSD11B1CHRM2CHRM1
SCHEMBL30484715 0.81 ATM (0.32) HSD11B1
SCHEMBL14488388 0.80 HSD17B10 (0.46) HSD17B10SMN1; SMN2HSD11B1NPC1EPHX2
SCHEMBL16824583 0.80 HSD17B10 (0.46) HSD17B10SMN1; SMN2HSD11B1NPC1EPHX2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294534-A1 IMIDAZOTRIAZINE DERIVATIVES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2024-09-05 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-20240294534-A1 IMIDAZOTRIAZINE DERIVATIVES AS IL-17 MODULATORS IL17A, IL2, IL15 HSD17B10 519/4885SMN1; SMN2 3456/4885HSD11B1 242/4885

“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.