SCHEMBL9723770

SCHEMBL9723770

C=CCCCCCCCCCCCCCCCCC(=O)C1CCCNCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
ABCC4 O15439 1/20 0.42
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34
GABRE P78334 1/20 0.34
PMP22 Q01453 1/20 0.34
GABRA6 Q16445 1/20 0.34
GABRG1 Q8N1C3 1/20 0.34

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
SCHEMBL9723819 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723878 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723809 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723729 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723727 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723831 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723775 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723801 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723850 0.98 MAPT (0.40) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL9723744 0.94 TSHR (0.36) MAPTABCC4ALDH1A1LMNATSHR

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-0368933-B1 COMPOSITIONS COMPRISING 1-OXO- OR THIOHYDROCARBYL SUBSTITUTED AZACYCLOALKANES Whitby Research Incorporated (US) 1992-10-14 EP disclosed
EP-0368933-A1 COMPOSITIONS COMPRISING 1-OXO- OR THIOHYDROCARBYL SUBSTITUTED AZACYCLOALKANES Whitby Research Incorporated (US) 1990-05-23 EP disclosed