SCHEMBL9770265

SCHEMBL9770265

NC(=O)C1(N=NC2(C(N)=O)CCCCC2)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.32
LMNA P02545 2/20 0.32
USP2 O75604 1/20 0.32
CYP1A2 P05177 1/20 0.32
BLM P54132 1/20 0.32
CACNA2D1 P54289 1/20 0.32
CYP2C19 P33261 2/20 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
SCHEMBL11625620 0.81 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL11625622 0.81 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL11493278 0.81 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL11493276 0.81 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL8165163 0.76 CYP2C19 (0.41) ALDH1A1SMN1; SMN2TSHRLMNAUSP2
SCHEMBL8165164 0.76 CYP2C19 (0.41) ALDH1A1SMN1; SMN2TSHRLMNAUSP2
SCHEMBL11491824 0.75 SPHK1 (0.31) ALDH1A1SMN1; SMN2LMNA
SCHEMBL11491830 0.75 SPHK1 (0.31) ALDH1A1SMN1; SMN2LMNA
SCHEMBL137137 0.74
SCHEMBL7717726 0.73 DGAT1 (0.39) ALDH1A1SMN1; SMN2

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-5077165-A Photoconductive layers of zinc oxide and hydrophilic binder resins; antistatic agents FUJI PHOTO FILM CO., LTD. (JP) 1991-12-31 US disclosed