SCHEMBL6934824

SCHEMBL6934824

NNc1ccccc1CCCCCO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 10/20 0.41
▸ TRPV1 Q8NER1 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ LIPG Q9Y5X9 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CA2 P00918 1/20 0.35
▸ KCNH3 Q9ULD8 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
SCHEMBL7258705 0.84 ALDH1A1 (0.42) SLC16A3TRPV1ALDH1A1GAAMAPT
SCHEMBL2178352 0.80 LIPG (0.47) LIPGPOLBTDP1CA2KCNH3
SCHEMBL27603742 0.79 SLC16A3 (0.39) SLC16A3TRPV1ALDH1A1GAAMAPT
SCHEMBL1495175 0.79 LIPG (0.50) SLC16A3ALDH1A1GAAMAPTLIPG
Hydrochloric Acid SCHEMBL28282712 0.78 LIPG (0.49) SLC16A3ALDH1A1GAAMAPTLIPG
SCHEMBL30750761 0.77 LIPG (0.43) ALDH1A1GAAMAPTKDM4EHPGD
SCHEMBL9672220 0.77 LIPG (0.43) ALDH1A1GAAMAPTKDM4EHPGD
SCHEMBL15187595 0.77 ALDH1A1 (0.38) SLC16A3TRPV1ALDH1A1GAAMAPT
SCHEMBL29573161 0.77 POLB (0.44) SLC16A3ALDH1A1GAAMAPTLIPG
SCHEMBL7446162 0.77 POLB (0.44) SLC16A3ALDH1A1GAAMAPTLIPG

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
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 — — EP disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 — — WO disclosed
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