SCHEMBL7706607

SCHEMBL7706607

CCCCC(CC)CC(CCC)=C(CC)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.45
CYP3A4 P08684 4/20 0.41
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPK1 P28482 1/20 0.38
RECQL P46063 1/20 0.35
BCL2L1 Q07817 1/20 0.35
THRB P10828 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
PGGT1B P53609 1/20 0.35
GRIK1 P39086 1/20 0.34
GRIA4 P48058 1/20 0.34
GRIK3 Q13003 1/20 0.34
GRIK5 Q16478 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34

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
SCHEMBL30798357 0.83 FNTA (0.49) CA2CYP3A4TSHRTDP1ATM
SCHEMBL225441 0.81 CA2 (0.50) CA2CYP3A4TSHRTDP1ATM
SCHEMBL226707 0.81 CA2 (0.50) CA2CYP3A4TSHRTDP1ATM
SCHEMBL183724 0.81 CA2 (0.50) CA2CYP3A4TSHRTDP1ATM
SCHEMBL227553 0.79 CA2 (0.42) CA2CYP3A4TSHRTDP1ATM
SCHEMBL5611375 0.78 CA2 (0.49) CA2CYP3A4TSHRTDP1ATM
SCHEMBL5611373 0.78 CA2 (0.49) CA2CYP3A4TSHRTDP1ATM
SCHEMBL5611571 0.77 FNTA (0.49) CA2CYP3A4TSHRTDP1ATM
SCHEMBL5611575 0.77 FNTA (0.49) CA2CYP3A4TSHRTDP1ATM
SCHEMBL9118016 0.77 CA2 (0.43) CA2CYP3A4TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6387398-B1 Process for producing cosmetic and pharmaceutical formulations, and products comprising same DRAGOCO GERBERDING & CO. AG (DE) 2002-05-14 US disclosed
US-6045823-A SHAPED SOLID PRODUCT COMPRISING AN ORGANIC MATRIX IN WHICH ARE HOMOGENOUSLY DISPERSED, SPRAY DRIED PARTICLES OF STARCH, HYDROCOLLOID GUM, ACTIVE AGENT-CONTAINING LIPOSOMES; DEODORANTS, LIPSTICKS DRAGOCO GERBERDING & CO. AG (DE) 2000-04-04 US disclosed
EP-0974332-A1 Process for producing cosmetic and pharmaceutical formulations, and products comprising same Dragoco Gerberding & Co Aktiengesellschaft (DE) 2000-01-26 EP disclosed