SCHEMBL17554264

SCHEMBL17554264

C#Cc1ccc(C23CC4CC(C2)CC(c2ccc(C#C)cc2)(C4)C3(c2ccc(C#C)cc2)c2ccc(C#C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 6/20 0.36
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
CYP2C9 P11712 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
SCHEMBL1076951 0.82 PGR (0.54) PGR
SCHEMBL16395687 0.77 PGR (0.33) PGRALDH1A1
SCHEMBL1332710 0.76 CXCR3 (0.39) ALDH1A1LMNA
SCHEMBL9418932 0.76 LMNA (0.34) ALDH1A1LMNA
SCHEMBL9418910 0.76 MEN1 (0.49) ALDH1A1LMNA
SCHEMBL28263951 0.76 ALDH1A1 (0.57) PGRALDH1A1LMNA
SCHEMBL419847 0.76 LMNA (0.57) PGRALDH1A1LMNA
SCHEMBL4172174 0.75 GRIN2D (0.47)
Bromide SCHEMBL27584845 0.73 GRIN2D (0.46)
Bromide SCHEMBL27599338 0.73 GRIN2D (0.46)

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
EP-2992947-B1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME KARLSRUHER INST TECHNOLOGIE (DE) 2023-03-01 EP disclosed
CN-114168587-A System and method for generating smell data and database thereof 苏星 2022-03-11 CN disclosed
EP-2992947-A1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME Karlsruher Institut für Technologie (DE) 2016-03-09 EP disclosed