SCHEMBL13480481

SCHEMBL13480481

CO[C@@H]1CCCC[C@@H]1CO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
APOBEC3A P31941 2/20 0.38
APOBEC3G Q9HC16 2/20 0.38
PABPC1 P11940 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 6/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.33
OPRK1 P41145 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30

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
SCHEMBL13866608 1.00 KDM4E (0.39) KDM4EAPOBEC3AAPOBEC3GPABPC1TDP1
SCHEMBL18535549 0.95
SCHEMBL24234512 0.95
SCHEMBL8970106 0.95
SCHEMBL26008603 0.85
SCHEMBL25746128 0.85
SCHEMBL23883762 0.85
SCHEMBL27209922 0.85
SCHEMBL19565543 0.80 KDM4E (0.32) KDM4EAPOBEC3AAPOBEC3GPABPC1TDP1
SCHEMBL25398423 0.80 TDP1 (0.40) APOBEC3AAPOBEC3GPABPC1TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655699-B1 Compounds having selective activity for retinoid X receptors, and means for modulation of processes mediated by retinoid X receptors EISAI INC. (US) 2010-02-02 US disclosed