SCHEMBL9003672

SCHEMBL9003672

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)(c1ccccc1)N(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.48
EBP Q15125 1/20 0.48
KCNN4 O15554 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
DNM1 Q05193 1/20 0.39
KCNH2 Q12809 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
DRD2 P14416 1/20 0.37
OPRM1 P35372 1/20 0.37
DRD3 P35462 1/20 0.37
ATM Q13315 1/20 0.36
GAA P10253 1/20 0.36
SCN5A Q14524 3/20 0.36
SCN9A Q15858 3/20 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
Iodide SCHEMBL38651193 0.98 SIGMAR1 (0.47) SIGMAR1EBPKCNN4CHRM2CHRM4
Hydrochloric Acid SCHEMBL27685587 0.98 SIGMAR1 (0.47) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082779 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082647 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28245123 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082659 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28083092 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082998 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082507 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4
Bromide SCHEMBL28082771 0.91 SIGMAR1 (0.42) SIGMAR1EBPKCNN4CHRM2CHRM4

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-0566270-B1 Coated recording sheets XEROX CORP (US) 1996-09-25 EP claimed