SCHEMBL5611403

SCHEMBL5611403

CCCCOOC(C)(OOCCCC)C(CC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.34
HSPD1 P10809 1/20 0.34
BLM P54132 1/20 0.34
HSPE1 P61604 1/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CA1 P00915 2/20 0.33
HCAR2 Q8TDS4 1/20 0.33
ATM Q13315 1/20 0.32
SLC1A2 P43004 2/20 0.32
SLC1A1 P43005 2/20 0.32
SLC1A3 P43003 1/20 0.32
GPR84 Q9NQS5 3/20 0.32
FFAR1 O14842 1/20 0.32
GRIK1 P39086 1/20 0.31

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
SCHEMBL339957 0.76 TSHR (0.33) CA2MAPK1HPGDMEN1RECQL
SCHEMBL10611374 0.74 CA2 (0.65) CA2MAPK1ALDH1A1MEN1KMT2A
SCHEMBL24167 0.73 CA2 (0.31) CA2MAPK1ALDH1A1TSHR
SCHEMBL27087989 0.72 CA2 (0.36) CA2MAPK1ALDH1A1HSPD1BLM
SCHEMBL9739314 0.72 HPGD (0.32) CA2MAPK1ALDH1A1HPGDHCAR2
SCHEMBL474943 0.72 ALDH1A1 (0.40) CA2MAPK1ALDH1A1HPGDHCAR2
SCHEMBL8023987 0.70 HSPD1 (0.38) CA2MAPK1ALDH1A1HSPD1BLM
SCHEMBL11668392 0.70 CA2 (0.46) CA2MAPK1HSPD1BLMHSPE1
SCHEMBL1007438 0.70 CA2 (0.50) CA2MAPK1MEN1KMT2ACA1
2-Ethylhexanoic Acid SCHEMBL8667915 0.69 CA2 (0.77) CA2MAPK1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007054065-A1 BELT HAVING A POLYMER BLEND CONTAINING AN ETHYLENE-α-OLEFIN-ELASTOMER, METHOD FOR THE PRODUCTION THEREOF, AND USE OF A BLEND OF TYPE FOR PRODUCING BELTS ARNTZ BETEILIGUNGS GMBH & CO. KG (DE) 2007-05-18 WO disclosed
EP-0259537-B1 PROCESS FOR REDUCING RESIDUAL MONOMERS IN LOW VISCOSITY POLYMER-POLYOLS ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) 1992-03-25 EP disclosed
EP-0129723-B1 CURABLE POLY(ACRYLATE) MOLDING COMPOSITIONS CONTAINING A THERMOPLASTIC POLYMER LOW PROFILE ADDITIVE UNION CARBIDE CORPORATION (US) 1991-12-18 EP disclosed
US-4404319-A UNSATURATED POLYESTER, MALEIC ANHYDRIDE, UNSATD COMPOUND, CURABLE UNION CARBIDE CORPORATION (US) 1983-09-13 US disclosed
US-3964950-A BONDING DIP FOR TIRE REINFORCEMENT FABRICSVINYL PYRIDINE TERPOLYMER, RESORCINOL-FORMALDEHYDE RESIN, PEROXIDE THE GENERAL TIRE & RUBBER COMPANY (US) 1976-06-22 US disclosed