SCHEMBL7319898

SCHEMBL7319898

Cc1cc(C)c(CCCCCC(=O)O)c(O)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 3/20 0.47
FABP4 P15090 1/20 0.47
RXFP1 Q9HBX9 2/20 0.43
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
IMPDH1 P20839 2/20 0.41
SCD O00767 1/20 0.41
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
ALDH1A1 P00352 2/20 0.39
PRNP P04156 1/20 0.39
RECQL P46063 1/20 0.39
PPARA Q07869 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38

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
SCHEMBL7330244 1.00 F13A1 (0.47) F13A1FABP4RXFP1MAPTNPSR1
SCHEMBL7329199 1.00 F13A1 (0.47) F13A1FABP4RXFP1MAPTNPSR1
SCHEMBL10769705 0.86 F13A1 (0.53) F13A1FABP4RXFP1MAPTNPSR1
SCHEMBL7321876 0.80 PLA2G2A (0.51) F13A1FABP4LMNATSHRNFKB1
SCHEMBL7329390 0.80 PLA2G2A (0.51) F13A1FABP4LMNATSHRNFKB1
SCHEMBL7330296 0.79 TLR8 (0.35) MAPTLMNAALDH1A1
SCHEMBL7328569 0.79 TSHR (0.46) F13A1FABP4RXFP1MAPTIMPDH1
SCHEMBL10058175 0.79 TLR8 (0.35) MAPTLMNAALDH1A1
SCHEMBL7331003 0.78 PLA2G2A (0.49) FABP4NPSR1
SCHEMBL5800572 0.77 CYP19A1 (0.46) NPSR1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4525361-A FOR PHYSIOLOGICAL HOST DEFENSE CONTROL ACTIVITY IN MAMMALS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-06-25 US disclosed
US-4407757-A IMMUNOLOGY AGENT, MUSCLE RELAXANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-10-04 US disclosed
US-4271083-A IMMUNO-POTENTIATING ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-06-02 US disclosed
US-4139545-A IMMUNO-POTENTIATORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-02-13 US disclosed