SCHEMBL20179337

SCHEMBL20179337

COCCNCOCC1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
EPHX2 P34913 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
SPHK1 Q9NYA1 10/20 0.33
KDM4E B2RXH2 2/20 0.31
NAAA Q02083 1/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
SPHK2 Q9NRA0 4/20 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
SCHEMBL7946281 0.77 ADH1B (0.42) LMNAEPHX2SMN1; SMN2KDM4EPOLB
SCHEMBL7739488 0.77 GBA1 (0.40) LMNASMN1; SMN2SPHK1NAAATSHR
SCHEMBL7739141 0.77 GBA1 (0.40) LMNASMN1; SMN2SPHK1NAAATSHR
SCHEMBL7738516 0.77 GBA1 (0.40) LMNASMN1; SMN2SPHK1NAAATSHR
SCHEMBL7732765 0.77 GBA1 (0.40) LMNASMN1; SMN2SPHK1NAAATSHR
SCHEMBL7739679 0.77 GBA1 (0.40) LMNASMN1; SMN2SPHK1NAAATSHR
SCHEMBL628429 0.76 SIGMAR1 (0.41) LMNAEPHX2SMN1; SMN2NAAAALDH1A1
SCHEMBL7741596 0.74 GBA1 (0.37) SMN1; SMN2SPHK1NAAAALDH1A1TSHR
Hydrochloric Acid SCHEMBL1677339 0.74 SIGMAR1 (0.40) LMNAEPHX2SMN1; SMN2NAAAALDH1A1
SCHEMBL12268104 0.70 TSHR (0.34) SMN1; SMN2SPHK1NAAAALDH1A1TSHR

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
WO-2018091756-A1 PREPARATION OF NEW BIOCONJUGATES AND ANTIBODIES FOR THE IMMUNODETECTION OF OCHRATOXIN A CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2018-05-24 WO disclosed