SCHEMBL11068508

SCHEMBL11068508

Cc1cc(=O)[nH]c2ccc(OCCCCl)cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
KDM4E B2RXH2 6/20 0.48
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 3/20 0.48
TSHR P16473 2/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 2/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PDE3B Q13370 8/20 0.47
PDE3A Q14432 8/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
PPARA Q07869 1/20 0.46
AR P10275 1/20 0.45
GLA P06280 1/20 0.43
TP53 P04637 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
SCHEMBL1039281 0.88 KDM4E (0.63) LMNAKDM4EALDH1A1HPGDGAA
SCHEMBL11272206 0.86 LMNA (0.48) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL1038244 0.84 KDM4E (0.61) LMNAKDM4EALDH1A1HPGDGAA
SCHEMBL19242935 0.83 KDM4E (0.66) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL27546739 0.80 LMNA (0.48) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL11277251 0.79 KDM4E (0.46) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL2798566 0.78 KDM4E (0.75) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL7037717 0.78 PDE3B (0.54) KDM4EALDH1A1HSD17B10TSHRHPGD
SCHEMBL10285854 0.78 KDM4E (0.65) KDM4EALDH1A1TSHRHPGDGAA
SCHEMBL11272074 0.78 PDE3B (0.54) LMNAKDM4EPDE3BPDE3ACYP1A2

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed