SCHEMBL5480009

SCHEMBL5480009

CCOC(=O)C1(O)CC1C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.37
ATM Q13315 1/20 0.36
ALOX15 P16050 2/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.33
OPRM1 P35372 1/20 0.33
HTT P42858 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
SCHEMBL18346711 0.80 ALOX15 (0.42) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL5116398 0.80 ALOX15 (0.42) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL28723335 0.79 KDM4E (0.36) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL20364186 0.78 F10 (0.40) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL9313180 0.78 F10 (0.40) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL18071114 0.78 F10 (0.40) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL12868635 0.77 ALDH1A1 (0.41) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL32674026 0.77 ALDH1A1 (0.41) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL17479967 0.77 ALDH1A1 (0.41) ALDH1A1LMNAKDM4EPOLBHSD17B10
SCHEMBL26521044 0.77 ALDH1A1 (0.41) ALDH1A1LMNAKDM4EPOLBHSD17B10

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
US-20070238830-A1 Aqueous polyurethane dispersions with improved storage stability BAYER MATERIALSCIENCE AG 2007-10-11 US disclosed
US-6667058-B1 Administering for analgesic therapy solid dosage form of flupirtine in which sedative side effects are largely or totally suppressed VIATRIS GMBH & CO. KG (DE) 2003-12-23 US disclosed
US-3941778-A Bis(triazinylamino) stilbene compounds SANDOZ LTD., (SANDOZ AG) (CH) 1976-03-02 US disclosed