SCHEMBL21373201

SCHEMBL21373201

CCCCCC=CCC=CCCCCCCCCC(CCCCCCCCC=CC/C=C\CCCCC)NC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
PPARG P37231 5/20 0.57
F7 P08709 4/20 0.57
F3 P13726 4/20 0.57
PPARD Q03181 4/20 0.57
PPARA Q07869 4/20 0.57
KDM4E B2RXH2 4/20 0.57
FFAR1 O14842 3/20 0.57
LMNA P02545 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP19A1 P11511 2/20 0.57
FABP4 P15090 2/20 0.57
HPGD P15428 2/20 0.57
ALOX15 P16050 2/20 0.57
PTGS1 P23219 2/20 0.57
AKR1C3 P42330 2/20 0.57
NR4A2 P43354 2/20 0.57
HSD17B10 Q99714 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
DUSP3 P51452 1/20 0.57

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
SCHEMBL20877099 1.00 ALDH1A1 (0.57) ALDH1A1PPARGF7F3PPARD
SCHEMBL21373200 1.00 ALDH1A1 (0.57) ALDH1A1PPARGF7F3PPARD
SCHEMBL4758573 0.95 TERT (0.53) PPARGF7F3PPARDPPARA
SCHEMBL4758572 0.95 TERT (0.53) PPARGF7F3PPARDPPARA
SCHEMBL16323618 0.88 FASN (0.54) ALDH1A1PPARGKDM4ETSHRMEN1
SCHEMBL16323324 0.88 FASN (0.54) ALDH1A1PPARGKDM4ETSHRMEN1
SCHEMBL16323325 0.88 FASN (0.54) ALDH1A1PPARGKDM4ETSHRMEN1
SCHEMBL16323616 0.88 FASN (0.54) ALDH1A1PPARGKDM4ETSHRMEN1
SCHEMBL20835136 0.87 PPARG (0.49) ALDH1A1PPARGF7F3PPARD
SCHEMBL27277689 0.87 ALDH1A1 (0.56) ALDH1A1PPARGF7F3PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541945-A2 COMPOSITIONS AND METHODS FOR TARGET NUCLEIC ACID MODIFICATION Genedit Inc. (US) 2019-09-25 EP disclosed