SCHEMBL17827044

SCHEMBL17827044

CCCCC1CC[C@@H](C)C(O)C1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
CYP1A2 P05177 1/20 0.43
LSS P48449 2/20 0.37
GLB1 P16278 1/20 0.37
MAPT P10636 1/20 0.37
TLR4 O00206 1/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
GBA1 P04062 1/20 0.34
TRPV1 Q8NER1 4/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
FUCA1 P04066 1/20 0.33
NAAA Q02083 1/20 0.33

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
SCHEMBL10158419 1.00 LMNA (0.44) LMNAMAPK1HTTCYP1A2LSS
SCHEMBL10053743 0.88 CA1 (0.39) LMNAMAPK1HTTMAPTGBA1
SCHEMBL21773610 0.88 CA1 (0.39) LMNAMAPK1HTTMAPTGBA1
SCHEMBL12279488 0.88 CA1 (0.39) LMNAMAPK1HTTMAPTGBA1
SCHEMBL12166491 0.84 LMNA (0.44) LMNAMAPK1HTTCYP1A2LSS
SCHEMBL20203309 0.83 CYP1A2 (0.46) LMNAMAPK1HTTCYP1A2LSS
SCHEMBL11903679 0.81 CYP1A2 (0.48) LMNAMAPK1HTTCYP1A2LSS
SCHEMBL12166845 0.80 CYP1A2 (0.43) LMNAMAPK1HTTCYP1A2LSS
SCHEMBL19197712 0.79 CA1 (0.39) CA1CA2CA4
SCHEMBL12166548 0.79 CA1 (0.39) CA1CA2CA4

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-3181669-A1 WATER-SOLUBLE UNIT DOSE ARTICLE The Procter and Gamble Company (US) 2017-06-21 EP disclosed
WO-2016094599-A1 A PROCESS FOR MAKING A CONSUMER GOODS PRODUCT COMPRISING A BENEFIT DELIVERY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2016-06-16 WO disclosed
EP-3031893-A1 A PROCESS FOR MAKING A CONSUMER GOODS PRODUCT COMPRISING A BENEFIT DELIVERY COMPOSITION The Procter and Gamble Company (US) 2016-06-15 EP disclosed