SCHEMBL5317568

SCHEMBL5317568

O=C(O)c1cc(NCCOc2ccc(F)cc2)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.60
STING1 Q86WV6 1/20 0.60
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
NOX4 Q9NPH5 2/20 0.48
RGS12 O14924 1/20 0.48
EGFR P00533 1/20 0.48
LCK P06239 1/20 0.48
CAMKK2 Q96RR4 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4C Q9H3R0 2/20 0.47
KDM4E B2RXH2 3/20 0.46
MCL1 Q07820 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.46
POLB P06746 2/20 0.44
NPC1 O15118 1/20 0.44
FAAH O00519 1/20 0.43
ADRA1D P25100 1/20 0.43
HTR2C P28335 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
SCHEMBL3413452 0.96 PPARA (0.58) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3420673 0.89 ALDH1A1 (0.57) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3419319 0.88 KDM4C (0.50) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3417329 0.88 KDM4C (0.62) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3420612 0.88 KMT2A (0.53) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3417360 0.88 ALDH1A1 (0.48) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3414987 0.88 CA1 (0.49) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL5320807 0.87 MCL1 (0.56) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL5318548 0.86 MAPT (0.48) PPARASTING1ALDH1A1MAPTNOX4
SCHEMBL3420301 0.85 ALDH1A1 (0.56) PPARASTING1ALDH1A1MAPTNOX4

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
WO-2007119984-A1 SALICYLIC ACID DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THEM NEUROTECH CO., LTD. (KR) 2007-10-25 WO claimed
WO-2007119984-A1 SALICYLIC ACID DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING THEM NEUROTECH CO., LTD. (KR) 2007-10-25 WO disclosed