SCHEMBL12867289

SCHEMBL12867289

CC(C)(C)Cc1cc(Cl)c(O)cn1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
MAPK14 Q16539 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
ESR1 P03372 1/20 0.31
PGK1 P00558 1/20 0.31

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
SCHEMBL19700919 0.82 ESR1 (0.34) HPGDHSD17B10GRNSORT1ESR1
SCHEMBL16502348 0.79 PGK1 (0.37) HPGDTSHRHSD17B10CA1CA2
SCHEMBL18367847 0.76 MAPK14 (0.32) MAPK14
SCHEMBL7974985 0.74 ALOX15 (0.39) HPGDTSHRHSD17B10ESR1PGK1
SCHEMBL2076822 0.74 HTT (0.36) HPGDTSHRHSD17B10GRNSORT1
SCHEMBL12867277 0.71 LNPEP (0.36)
SCHEMBL3645230 0.71 KDM4E (0.30) HPGD
SCHEMBL21325077 0.70 ESR1 (0.33) GRNSORT1ESR1
SCHEMBL24553502 0.67 NNMT (0.41) HPGDTSHRHSD17B10
SCHEMBL30826984 0.67 ESR1 (0.49) HPGDTSHRHSD17B10ESR1

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-20110046160-A1 Novel Class of Spiro Piperidines for the Treatment of Neurodegenerative Diseases PFIZER, INC. 2011-02-24 US disclosed
US-20110046160-A1 Novel Class of Spiro Piperidines for the Treatment of Neurodegenerative Diseases PFIZER, INC. 2011-02-24 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-20110046160-A1 Novel Class of Spiro Piperidines for the Treatment of Neurodegenerative Diseases SNCA, PARK7, HTT HPGD 516/4885TSHR 2618/4885HSD17B10 2736/4885

“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.