SCHEMBL13770474

SCHEMBL13770474

CC1C[N+](C)(CC2CO2)CC1C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CTDSP1 Q9GZU7 2/20 0.31
POLB P06746 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
THRB P10828 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
PABPC1 P11940 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
SCHEMBL9999776 0.77 THRB (0.32) ALDH1A1THRB
SCHEMBL11552985 0.73 CTDSP1 (0.50) ALDH1A1CTDSP1POLBAPOBEC3AAPOBEC3G
SCHEMBL19164699 0.71 CTDSP1 (0.44) ALDH1A1CTDSP1POLBAPOBEC3AAPOBEC3G
SCHEMBL9118629 0.71 CTDSP1 (0.37) ALDH1A1CTDSP1POLBAPOBEC3AAPOBEC3G
Hydrochloric Acid SCHEMBL3759338 0.70 CTDSP1 (0.36) CTDSP1POLBAPOBEC3AAPOBEC3GTHRB
SCHEMBL11338454 0.70 THRB (0.53) CTDSP1POLBAPOBEC3AAPOBEC3GTHRB
Hydrochloric Acid SCHEMBL9635896 0.70 CTDSP1 (0.51) CTDSP1POLBAPOBEC3AAPOBEC3GTDP1
Hydrochloric Acid SCHEMBL295168 0.68 THRB (0.51) CTDSP1POLBAPOBEC3AAPOBEC3GTHRB
Hydrochloric Acid SCHEMBL11552155 0.67 CTDSP1 (0.35) CTDSP1POLBAPOBEC3AAPOBEC3GTHRB
SCHEMBL19164761 0.60 ALDH1A1 (0.38) ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8453849-B2 Anti-microbial matrix and filtration system 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-06-04 US disclosed
US-8453849-B2 Anti-microbial matrix and filtration system 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-06-04 US disclosed
US-7566381-B2 Low odor binders curable at room temperature KIMBERLY-CLARK WORLDWIDE, INC. (US) 2009-07-28 US disclosed
US-20070187056-A1 Low odor binders curable at room temperature KIMBERLY-CLARK WORLDWIDE, INC. 2007-08-16 US disclosed