SCHEMBL11005552

SCHEMBL11005552

O=C(O)CCCCC(=O)NC(O)(O)C(O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
NFKB1 P19838 2/20 0.42
TSHR P16473 2/20 0.42
PMP22 Q01453 1/20 0.42
SLC22A6 Q4U2R8 2/20 0.39
ALDH1A1 P00352 2/20 0.37
FFAR1 O14842 2/20 0.37
FFAR4 Q5NUL3 2/20 0.37
GPR84 Q9NQS5 2/20 0.37
AKR1B1 P15121 1/20 0.37
CYP2D6 P10635 1/20 0.37
FOLH1 Q04609 1/20 0.37
PRMT1 Q99873 1/20 0.36
EPHX2 P34913 2/20 0.36
SLC22A8 Q8TCC7 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL11005557 0.92 ALDH1A1 (0.42) TSHRALDH1A1
SCHEMBL8160692 0.84 ALDH1A1 (0.37) ALDH1A1
SCHEMBL11005567 0.72 LMNA (0.44) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL27799608 0.69 LMNA (0.58) LMNANFKB1TSHRPMP22SLC22A6
SCHEMBL12048596 0.67 TSHR (0.60) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL2244299 0.66 LMNA (1.00) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL1330953 0.66 LMNA (1.00) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL8941691 0.66 LMNA (1.00) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL4930 0.66 LMNA (1.00) LMNANFKB1TSHRPMP22SLC22A6
Adipic Acid SCHEMBL25482 0.66 LMNA (1.00) LMNANFKB1TSHRPMP22SLC22A6

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
US-4540626-A Polyhydroxyalkyl polycarbonamides for the production of flame-resistant polyurethane rigid foams and integral foams BAYER AG (DE) 1985-09-10 US claimed