SCHEMBL28279331

SCHEMBL28279331

CC(NC(=O)c1ccccc1)C(=O)OC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.48
FAP Q12884 1/20 0.48
LMNA P02545 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
SCN1A P35498 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 0.47
CYP19A1 P11511 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
ANPEP P15144 2/20 0.45
LTA4H P09960 1/20 0.45
LAP3 P28838 1/20 0.45
NPEPPS P55786 1/20 0.45
ERAP2 Q6P179 1/20 0.45
ERAP1 Q9NZ08 1/20 0.45
ACE P12821 1/20 0.45
CTSL P07711 1/20 0.44

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
SCHEMBL7663015 0.83 CTSL (0.50) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL28700852 0.81 CYP19A1 (0.48) LMNACYP1A2CYP19A1SMN1; SMN2NPC1
SCHEMBL7666109 0.80 LMNA (0.47) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL28841763 0.80 FAAH (0.49) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL29615023 0.79 LMNA (0.49) LMNACYP1A2CYP2D6CYP19A1SMN1; SMN2
SCHEMBL26276986 0.79 CYP1A2 (0.55) PREPLMNACYP1A2CTSLCTSB
SCHEMBL28855000 0.79 CYP1A2 (0.55) PREPLMNACYP1A2CTSLCTSB
SCHEMBL607313 0.79 CYP1A2 (0.55) PREPLMNACYP1A2CTSLCTSB
SCHEMBL5709900 0.78 CYP19A1 (0.50) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL1491624 0.78 FAAH (0.47) LMNACYP1A2CYP2D6SCN1ASCN2A

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
CN-109476946-A Optics fadout color-changing composition and its method made and used 西甘产业股份有限公司 2019-03-15 CN disclosed