SCHEMBL14637294

SCHEMBL14637294

CCCCCCC(C(N)=O)C(C)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
LTA4H P09960 2/20 0.44
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HDAC3 O15379 1/20 0.41
ACACB O00763 2/20 0.40
ACACA Q13085 2/20 0.40
CETP P11597 1/20 0.40
MME P08473 1/20 0.40
ICMT O60725 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL4183112 0.87 MME (0.50) ALDH1A1MME
SCHEMBL14637806 0.81 ALOX5 (0.43) MMP9MMP8MMP13LMNAALDH1A1
SCHEMBL11862111 0.81 SOAT1 (0.46) ALDH1A1MME
SCHEMBL11862095 0.81 SOAT1 (0.46) ALDH1A1MME
SCHEMBL11593762 0.79 KDM4E (0.49) LMNAALDH1A1PPARGPPARA
SCHEMBL11042231 0.79 HMGCR (0.44) ALDH1A1MME
SCHEMBL7077499 0.78 MME (0.56) ALDH1A1MME
SCHEMBL28896749 0.77 CTRC (0.58) LMNA
SCHEMBL3631075 0.76 MME (0.52) MME
SCHEMBL18248605 0.74 ALDH1A1 (0.42) MMP9MMP8MMP13LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2732033-A1 LIPASE VARIANTS AND POLYNUCLEOTIDES ENCODING SAME Novozymes A/S (DK) 2014-05-21 EP disclosed
WO-2013010783-A1 LIPASE VARIANTS AND POLYNUCLEOTIDES ENCODING SAME NOVOZYMES A/S (DK) 2013-01-24 WO disclosed