SCHEMBL7848898

SCHEMBL7848898

CCCCN(CCO)CCN(CCCC)CCN(CCCC)CCN(CCCC)CCN(CCO)CCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
KDM5A P29375 3/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
MAPT P10636 3/20 0.36
PHF8 Q9UPP1 2/20 0.36
KDM4C Q9H3R0 1/20 0.36
ALDH2 P05091 1/20 0.36

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
SCHEMBL9641267 1.00 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL11700546 1.00 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL7838829 1.00 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL43801 0.97 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL20629 0.97 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
Trolamine SCHEMBL11973736 0.97 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL7847234 0.94 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
SCHEMBL9641325 0.94 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
Hydrochloric Acid SCHEMBL1132199 0.94 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR
Bromide SCHEMBL1835568 0.94 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2LMNAHSD17B10TSHR

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
EP-1068959-A1 WATER RESISTANCE IMPROVING AGENT FOR INKJET RECORDING PAPER AND INKJET RECORDING PAPER Nicca Chemical Co., Ltd. (JP) 2001-01-17 EP disclosed