SCHEMBL19827773

SCHEMBL19827773

Cc1cc(C)c2c(c1)C(C)COC2

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UGT2B17 O75795 2/20 0.41
HSPA1A P0DMV8 1/20 0.31
PTPN7 P35236 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
SCHEMBL19827774 0.81 HTR2A (0.35)
SCHEMBL19829927 0.79 UGT2B17 (0.40) UGT2B17HSPA1APTPN7
SCHEMBL19827777 0.79 UGT2B17 (0.40) UGT2B17HSPA1APTPN7
SCHEMBL19829928 0.79 UGT2B17 (0.40) UGT2B17HSPA1APTPN7
Hydrochloric Acid SCHEMBL19810426 0.78 UGT2B17 (0.39) UGT2B17
SCHEMBL19827929 0.73 ACHE (0.41)
SCHEMBL11981385 0.73 ACHE (0.41)
SCHEMBL412687 0.72 UGT2B17 (0.56) UGT2B17
SCHEMBL19828189 0.72 ACHE (0.40)
SCHEMBL13315830 0.72 ACHE (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11077090-B2 Compounds and compositions and uses thereof SUNOVION PHARMACEUTICALS INC. (MA) 2021-08-03 US disclosed
WO-2018023070-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF SUNOVION PHARMACEUTICALS, INC. (US) 2018-02-01 WO disclosed
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF PGI DRUG DISCOVERY LLC 2018-02-01 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-11077090-B2 Compounds and compositions and uses thereof ACHE, CHAT, MAOB UGT2B17 237/4885HSPA1A 3449/4885PTPN7 3598/4885
US-20180028492-A1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF ACHE, CHAT, MAOB UGT2B17 237/4885HSPA1A 3449/4885PTPN7 3598/4885

“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.