SCHEMBL10247336

SCHEMBL10247336

CC(=O)O[C@@H]1CC[C@@]2(C)C(CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCC(=O)OCC(F)(F)S(=O)(=O)O)[C@@]4(C)CC[C@@H]32)C1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 4/20 0.69
▸ USP2 O75604 1/20 0.69
▸ ABCC4 O15439 3/20 0.60
▸ ST6GAL1 P15907 1/20 0.57
▸ ABCC1 P33527 1/20 0.54
▸ GPBAR1 Q8TDU6 2/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ HIF1A Q16665 1/20 0.54

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
SCHEMBL10245782 0.91 VDR (0.60) VDRUSP2ABCC4ST6GAL1ABCC1
SCHEMBL10245848 0.90 VDR (0.55) VDRUSP2ABCC4ST6GAL1GPBAR1
SCHEMBL10245617 0.90 VDR (0.54) VDRUSP2ABCC4GPBAR1
SCHEMBL10245609 0.90 VDR (0.54) VDRUSP2ABCC4GPBAR1
SCHEMBL10247319 0.89 GPBAR1 (0.70) VDRUSP2ABCC4ST6GAL1GPBAR1
SCHEMBL10245846 0.88 VDR (0.52) VDRUSP2ABCC4ST6GAL1ABCC1
SCHEMBL13411132 0.87 VDR (0.68) VDRUSP2ABCC4ST6GAL1ABCC1
SCHEMBL25701566 0.86 GPBAR1 (0.65) VDRUSP2ABCC4GPBAR1CYP2C9
SCHEMBL27353298 0.84 VDR (0.69) VDRUSP2ABCC4ST6GAL1GPBAR1
SCHEMBL10245745 0.84 CDC25A (0.63) VDRUSP2ABCC4ST6GAL1

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-8114571-B2 Photoacid generator, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-02-14 — — US disclosed
US-20090274978-A1 NOVEL PHOTOACID GENERATOR, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-11-05 — — 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-20090274978-A1 NOVEL PHOTOACID GENERATOR, RESIST COMPOSITION, AND PATTERNING PROCESS CYP21A2, C1S, C1R VDR 294/4885USP2 3557/4885ABCC4 2694/4885

“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.

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