SCHEMBL14705000

SCHEMBL14705000

CC(CCCCC(=O)O)NP

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
FFAR1 O14842 1/20 0.46
ALDH1A1 P00352 2/20 0.44
TSHR P16473 3/20 0.44
NFKB1 P19838 1/20 0.44
PMP22 Q01453 1/20 0.44
GSTK1 Q9Y2Q3 2/20 0.44
KDM4C Q9H3R0 2/20 0.43
KDM4A O75164 1/20 0.43
PHF8 Q9UPP1 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
AKR1B1 P15121 1/20 0.43
ENPEP Q07075 1/20 0.42
PPARG P37231 3/20 0.41
PPARD Q03181 3/20 0.41
PPARA Q07869 3/20 0.41
GPR84 Q9NQS5 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
TDP1 Q9NUW8 2/20 0.41

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
Hydrochloric Acid SCHEMBL9230401 0.79 LMNA (0.46) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL11543742 0.79 TSHR (0.50) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL10431575 0.76 ADRA1A (0.50) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL245252 0.75 KDM4C (0.60) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL9405817 0.75 LMNA (0.58) LMNAFFAR4FFAR1ALDH1A1TSHR
Hexanoate SCHEMBL3411762 0.75 FFAR4 (0.65) LMNAFFAR4FFAR1ALDH1A1TSHR
Hexanoate SCHEMBL3412902 0.75 FFAR4 (0.65) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL10874908 0.75 FFAR4 (0.46) LMNAFFAR4FFAR1ALDH1A1TSHR
Octanoic Acid SCHEMBL3413790 0.75 FFAR4 (0.65) LMNAFFAR4FFAR1ALDH1A1TSHR
SCHEMBL6267662 0.74 ENPEP (0.45) LMNAALDH1A1TSHRNFKB1PMP22

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
WO-2013021344-A1 IMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS LUPIN LIMITED (IN) 2013-02-14 WO disclosed