SCHEMBL4266329

SCHEMBL4266329

CC(=O)OC1=CC(O)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.33
LMNA P02545 1/20 0.32
ESR1 P03372 1/20 0.32
PGR P06401 1/20 0.32
CHRM2 P08172 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 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
SCHEMBL2585382 1.00 GLA (0.33) GLALMNAESR1PGRCHRM2
SCHEMBL3726007 0.73 ESR1 (0.33) GLALMNAESR1PGRCHRM2
SCHEMBL6899350 0.73 ESR1 (0.33) GLALMNAESR1PGRCHRM2
SCHEMBL10203319 0.73 ESR1 (0.31) ESR1PGRCHRM2ADORA3AR
SCHEMBL14307786 0.71
SCHEMBL3758701 0.71 ESR1 (0.39) ESR1PGRCHRM2ADORA3AR
SCHEMBL5191282 0.71 ESR1 (0.39) ESR1PGRCHRM2ADORA3AR
SCHEMBL5191287 0.71 ESR1 (0.39) ESR1PGRCHRM2ADORA3AR
SCHEMBL3758703 0.71 ESR1 (0.39) ESR1PGRCHRM2ADORA3AR
SCHEMBL3758711 0.71 ESR1 (0.39) ESR1PGRCHRM2ADORA3AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018069222-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-04-19 WO disclosed
US-20090312559-A1 CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES NATIONAL INSTITUTES OF HEALTH, U.S. DEPARTMENT OF HEALTH AND HUMAN SERVICES, U.S. GOVERNMENT 2009-12-17 US disclosed
WO-2007082026-A2 CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES THE TRUSTEES OF BOSTON COLLEGE (US) 2007-07-19 WO disclosed
US-5414173-A Process of preparing cyclopentadiene and substituted derivatives thereof THE DOW CHEMICAL COMPANY (US) 1995-05-09 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-20090312559-A1 CATALYTIC ENANTIOSELECTIVE SILYLATIONS OF SUBSTRATES LSS, COASY, CYP51A1 GLA 1348/4885LMNA 1731/4885ESR1 352/4885

“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.