SCHEMBL9225632

SCHEMBL9225632

CCCCCCCC(C)([O])C(CCC)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.47
MMP2 P08253 2/20 0.41
MMP3 P08254 2/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
PPARA Q07869 1/20 0.40
HDAC3 O15379 1/20 0.38
CETP P11597 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL9225590 0.89 MEN1 (0.40) MMP2MMP3MMP9ALDH1A1
SCHEMBL9222752 0.85 MMP1 (0.40) MMP2MMP3MMP9MMP8MMP13
SCHEMBL9226552 0.83 MEN1 (0.40) MMP2MMP3MMP9ALDH1A1
SCHEMBL9221905 0.83 CHRNA7 (0.34) MMP2MMP3MMP9PPARAALDH1A1
SCHEMBL9228212 0.82 CNR2 (0.36)
SCHEMBL9225864 0.81 GRIA4 (0.40) HDAC3ALDH1A1LMNASMN1; SMN2
SCHEMBL9224130 0.81 ATM (0.34)
SCHEMBL9227289 0.81 FAAH (0.34) MMP2ALDH1A1LMNA
SCHEMBL9227287 0.80 HTR2A (0.44) ALDH1A1LMNA
SCHEMBL9225116 0.76 CNR2 (0.40) LMNA

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
EP-0590020-B1 CURABLE ORGANOPOLYSILOXANE PREPARATIONS WACKER CHEMIE GMBH (DE) 1995-09-06 EP disclosed
US-5420222-A Curable organo(poly)siloxane compositions WACKER-CHEMIE GMBH (DE) 1995-05-30 US disclosed
EP-0590020-A1 CURABLE ORGANOPOLYSILOXANE PREPARATIONS. WAKKER CHEMIE GMBH (DE) 1994-04-06 EP disclosed
WO-1993000405-A1 CURABLE ORGANOPOLYSILOXANE PREPARATIONS WACKER-CHEMIE GMBH (DE) 1993-01-07 WO disclosed