SCHEMBL30003792

SCHEMBL30003792

Cc1cc(C2(c3ccc(OC#N)c(C)c3)CCCCC2)ccc1OC#N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.53
ESR2 Q92731 4/20 0.53
PPARA Q07869 1/20 0.50
ACHE P22303 1/20 0.45
LMNA P02545 5/20 0.43
ALOX12 P18054 5/20 0.43
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 2/20 0.32
MAPT P10636 1/20 0.32
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
PGR P06401 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL3421546 1.00 ESR1 (0.53) ESR1ESR2PPARAACHELMNA
SCHEMBL918949 1.00 ESR1 (0.53) ESR1ESR2PPARAACHELMNA
Phenol SCHEMBL8963230 0.89 ESR1 (0.50) ESR1ESR2PPARAACHELMNA
SCHEMBL9216407 0.81 ESR1 (0.39) ESR1ESR2PPARAACHELMNA
SCHEMBL25620272 0.80 ESR1 (0.59) ESR1ESR2PPARAACHELMNA
SCHEMBL19268516 0.80 ESR1 (0.59) ESR1ESR2PPARAACHELMNA
SCHEMBL17523062 0.80 ESR1 (0.59) ESR1ESR2PPARAACHELMNA
SCHEMBL918037 0.79 ACHE (0.53) ESR1ESR2PPARAACHELMNA
SCHEMBL19863729 0.78 ESR1 (0.58) ESR1ESR2PPARAACHELMNA
SCHEMBL8961826 0.77 MAOA (0.36) ESR1ESR2PPARAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4698582-A1 CURABLE ORGANOSILOXANE-MODIFIED REACTION RESINS Wacker Chemie AG (DE) 2026-02-25 EP disclosed
WO-2025031588-A1 CURABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2025-02-13 WO disclosed
WO-2024217692-A1 CURABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2024-10-24 WO disclosed
WO-2024213237-A1 CURABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2024-10-17 WO disclosed
EP-4347702-A1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS Wacker Chemie AG (DE) 2024-04-10 EP disclosed
EP-4153658-A1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS Wacker Chemie AG (DE) 2023-03-29 EP disclosed
WO-2022253413-A1 CROSS-LINKABLE ORGANOSILOXANE-MODIFIED REACTION RESINS WACKER CHEMIE AG (DE) 2022-12-08 WO disclosed