SCHEMBL17633433

SCHEMBL17633433

CC1(C)C2CCC1(C)[C@@H]([C@H]1CC[C@H](O)CC1)C2

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.36
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
SERPINA6 P08185 1/20 0.32

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
SCHEMBL1774430 1.00 EPHX2 (0.36) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL17627749 1.00 EPHX2 (0.36) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL27171589 0.81 GAA (0.36) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL28720361 0.81 GAA (0.36) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL10638000 0.81 EPHX2 (0.33) EPHX2MAPTMAPK1KMT2ASERPINA6
SCHEMBL27493897 0.81 EPHX2 (0.33) EPHX2MAPTMAPK1KMT2ASERPINA6
SCHEMBL29043131 0.80 EPHX2 (0.33) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL30184983 0.80 EPHX2 (0.40) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL1535778 0.78 CXCR3 (0.35) EPHX2MAPTMAPK1KMT2AALDH1A1
SCHEMBL27613455 0.78 CXCR3 (0.35) EPHX2MAPTMAPK1KMT2AALDH1A1

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-3197424-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP claimed
WO-2016049398-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed