SCHEMBL10708487

SCHEMBL10708487

O=C(O)CCCCc1ccc(C(=O)CCCl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
RXFP1 Q9HBX9 1/20 0.56
HSD17B10 Q99714 1/20 0.56
DPP4 P27487 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
GMNN O75496 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
CYP2D6 P10635 1/20 0.53
GABRA1 P14867 1/20 0.53
TSHR P16473 1/20 0.53
NFKB1 P19838 1/20 0.53
THPO P40225 1/20 0.53
GABRA2 P47869 1/20 0.53
GABRB2 P47870 1/20 0.53
PMP22 Q01453 1/20 0.53
HIF1A Q16665 1/20 0.53
SLCO1B3 Q9NPD5 1/20 0.53
HDAC3 O15379 2/20 0.51

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
SCHEMBL9771021 0.98 MAPT (0.59) MAPTRXFP1HSD17B10DPP4L3MBTL1
SCHEMBL27446088 0.88 THRA (0.66) MAPTRXFP1HSD17B10DPP4L3MBTL1
SCHEMBL7829240 0.88 DPP4 (0.65) MAPTRXFP1HSD17B10DPP4L3MBTL1
SCHEMBL6556728 0.83 THRA (0.55) DPP4L3MBTL1THRATHRBNPC1
SCHEMBL11109330 0.83 CYP4A11 (0.53) HSD17B10DPP4L3MBTL1ALDH1A1THRA
SCHEMBL7822245 0.82 HSD17B10 (0.68) MAPTRXFP1HSD17B10DPP4L3MBTL1
SCHEMBL31512079 0.82 L3MBTL1 (0.71) MAPTRXFP1HSD17B10DPP4L3MBTL1
SCHEMBL6938543 0.82 THRA (0.77) MAPTALDH1A1THRATHRB
SCHEMBL9077531 0.82 THRA (0.68) L3MBTL1ALDH1A1THRATHRB
SCHEMBL13730713 0.82 THRA (0.77) MAPTALDH1A1THRATHRB

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-4745076-A Ruthenium complexes useful as carriers for immunologically active materials HOFFMANN-LA ROCHE INC. (US) 1988-05-17 US disclosed