SCHEMBL4943644

SCHEMBL4943644

CCCCCOC(=O)C(O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.53
NAAA Q02083 1/20 0.50
EPHX1 P07099 1/20 0.47
ATM Q13315 1/20 0.47
TSHR P16473 3/20 0.46
GPR84 Q9NQS5 3/20 0.45
FFAR1 O14842 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.44
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL9222386 0.98 HCAR2 (0.55) HCAR2NAAAEPHX1ATMTSHR
SCHEMBL11670364 0.98 HCAR2 (0.55) HCAR2NAAAEPHX1ATMTSHR
SCHEMBL11520320 0.94 ATM (0.54) HCAR2NAAAEPHX1ATMTSHR
SCHEMBL9222382 0.87 NAAA (0.59) HCAR2NAAAEPHX1TSHRALDH1A1
SCHEMBL6670948 0.85 HCAR2 (0.48) HCAR2ATMTSHRGPR84FFAR1
SCHEMBL5792770 0.82 ALDH1A1 (0.58) HCAR2NAAAEPHX1ATMTSHR
Lactic Acid SCHEMBL30459106 0.82 NAAA (0.48) HCAR2NAAAEPHX1TSHRGPR84
SCHEMBL370999 0.82 NAAA (0.48) HCAR2NAAAEPHX1TSHRGPR84
SCHEMBL30525457 0.80 NAAA (0.56) HCAR2NAAAEPHX1ATMTSHR
SCHEMBL370998 0.80 NAAA (0.56) HCAR2NAAAEPHX1ATMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080210174-A1 Increasing the Protein Concentration of Animal Organisms BASF AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
CN-101111161-A Increasing protein concentration in animal organisms BASF AG (DE) 2008-01-23 CN disclosed