SCHEMBL8961782

SCHEMBL8961782

C=CCc1c(C)cccc1[O]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
ALDH1A1 P00352 5/20 0.34
GAA P10253 4/20 0.34
KDM4E B2RXH2 4/20 0.34
TDP1 Q9NUW8 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL1235826 0.85 MAPT (0.44) MAPTALDH1A1GAAKDM4ETDP1
SCHEMBL968136 0.78 GABRA1 (0.47) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL9003490 0.78 GABRA1 (0.47) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL15914234 0.77 GABRA1 (0.47) MAPTALDH1A1GAAKDM4EGABRA1
Formaldehyde SCHEMBL28639118 0.77 TRPA1 (0.42) MAPTALDH1A1GAAKDM4EGABRA1
Ammonia Solution, Strong SCHEMBL11198800 0.76 GABRA1 (0.46) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL30023289 0.76 TRPA1 (0.45) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL2321816 0.76 TRPA1 (0.45) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL29728153 0.76 ACHE (0.43) MAPTALDH1A1GAAKDM4EGABRA1
SCHEMBL28165934 0.76 MAPT (0.37) MAPTALDH1A1GAAKDM4ETDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0564275-B1 Antifouling paint NIPPON PAINT CO LTD (JP) 1996-01-31 EP disclosed
US-5332431-A Alkylphenoxy group containing organosilicon compound NIPPON PAINT CO., LTD. (JP) 1994-07-26 US disclosed
EP-0564275-A1 Antifouling paint NIPPON PAINT CO., LTD. (JP) 1993-10-06 EP disclosed